data_2kta_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 2kta _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.512 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 8.3 t-105 . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 120.634 0.254 . . . . 75.430000000000007 110.538 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.8 ' HA ' ' HE1' ' A' ' 10' ' ' MET . 2.7 tpt -56.64 -45.54 81.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.136 -0.483 . . . . 73.219999999999999 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmpt? -68.36 -45.21 73.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 73.340000000000003 110.798 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -69.62 -35.92 75.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.342 -0.39 . . . . 73.129999999999995 111.397 -177.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' A' ' 57' ' ' LEU . 44.4 t80 -59.29 -50.97 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.779 -0.191 . . . . 75.530000000000001 111.088 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.82 -25.05 64.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.817 0.342 . . . . 73.219999999999999 111.176 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.486 ' OE2' ' HG ' ' A' ' 34' ' ' LEU . 34.8 tt0 -72.18 -41.12 67.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 62.219999999999999 110.107 177.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.521 HD11 HD23 ' A' ' 34' ' ' LEU . 7.1 tt -79.94 -31.51 40.05 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.878 -0.786 . . . . 65.450000000000003 108.878 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.695 ' HA ' HD12 ' A' ' 61' ' ' ILE . 85.4 tttt -55.68 -49.78 72.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.194 . . . . 74.430000000000007 110.371 174.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 m -72.75 -31.08 64.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.44 -0.8 . . . . 74.239999999999995 110.793 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.624 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 29.3 t80 -70.81 -46.99 61.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 73.420000000000002 110.377 -178.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.868 HG21 ' H ' ' A' ' 25' ' ' ARG . 24.2 t -65.2 -34.27 69.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.358 -0.383 . . . . 65.109999999999999 111.688 177.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -58.5 -20.94 50.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.292 0.568 . . . . 72.109999999999999 109.983 175.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -100.48 -47.75 4.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.024 -0.535 . . . . 61.32 111.646 -176.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -111.49 -25.92 9.34 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.378 0.881 . . . . 74.329999999999998 113.378 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.843 ' HA ' HG13 ' A' ' 20' ' ' VAL . 3.0 mpt_? 60.21 92.03 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.908 -0.405 . . . . 70.319999999999993 109.908 -166.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.868 ' H ' HG21 ' A' ' 20' ' ' VAL . 33.3 ttt180 67.59 161.64 0.18 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.75 0.786 . . . . 73.049999999999997 111.548 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.624 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 5.7 p90 . . . . . 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 64.400000000000006 110.513 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.9 t30 . . . . . 0 N--CA 1.464 0.258 0 CA-C-O 120.607 0.242 . . . . 65.239999999999995 111.269 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.521 HD23 HD11 ' A' ' 16' ' ' LEU . 77.7 mt -66.96 -34.26 77.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.847 0.356 . . . . 73.530000000000001 110.141 178.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.29 -43.15 97.49 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 64.230000000000004 112.181 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.36 -39.15 57.77 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.839 -0.696 . . . . 63.119999999999997 111.417 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.481 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 6.3 t90 -60.15 -42.53 95.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.91 0.386 . . . . 73.530000000000001 110.444 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.5 t -66.14 -38.83 89.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 74.510000000000005 110.888 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.6 m80 -59.25 -47.86 83.79 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 73.140000000000001 110.64 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.451 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 9.2 m -67.22 -35.1 78.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.204 0.526 . . . . 72.120000000000005 110.571 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.481 ' HB2' ' O ' ' A' ' 37' ' ' TRP . 3.2 tp-100 -65.12 -28.37 69.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.567 -0.742 . . . . 74.310000000000002 111.675 -174.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -54.77 -46.5 74.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 75.310000000000002 110.939 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.545 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -74.04 -22.53 59.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.062 -0.517 . . . . 73.409999999999997 110.717 -176.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.477 ' CB ' ' HG ' ' A' ' 50' ' ' LEU . 25.7 mmt -67.09 -46.25 74.83 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.412 -0.588 . . . . 73.319999999999993 109.412 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.528 ' HB2' HD12 ' A' ' 50' ' ' LEU . 8.1 tmm_? -75.48 -35.68 60.8 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.272 -0.876 . . . . 74.510000000000005 109.819 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.496 ' HB3' ' HA ' ' A' ' 43' ' ' LYS . 1.7 tmtp? -61.0 -47.3 87.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.88 -0.6 . . . . 74.540000000000006 110.706 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -75.4 -31.86 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.142 -0.481 . . . . 74.310000000000002 110.873 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.36 21.65 37.31 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.825 -0.702 . . . . 73.219999999999999 111.85 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.443 ' HD3' ' SD ' ' A' ' 44' ' ' MET . 13.8 ptmt -95.96 -5.1 42.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.095 0.474 . . . . 72.219999999999999 109.763 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.528 HD12 ' HB2' ' A' ' 45' ' ' ARG . 1.3 mt -57.43 138.95 81.03 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.047 -0.979 . . . . 63.450000000000003 110.163 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 3.5 Cg_exo -82.46 128.09 5.32 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.115 2.543 . . . . 71.5 111.191 174.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -61.13 -28.54 69.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.817 -0.629 . . . . 53.350000000000001 111.806 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -66.87 -46.11 76.0 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.071 0.463 . . . . 60.130000000000003 109.973 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.512 ' HG2' ' CH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -62.44 -41.57 98.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.005 -0.739 . . . . 73.109999999999999 109.005 176.267 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -44.62 96.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.103 -0.953 . . . . 72.239999999999995 110.646 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.64 -41.99 74.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 73.120000000000005 111.724 -177.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HB3' ' CE1' ' A' ' 13' ' ' TYR . 5.9 mp -57.87 -43.07 85.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.709 0.262 . . . . 55.43 111.709 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.507 HD21 ' NH2' ' A' ' 54' ' ' ARG . 9.3 mp -71.6 -33.38 68.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 65.150000000000006 111.095 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.92 -38.37 90.73 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.225 0.535 . . . . 51.530000000000001 110.014 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -69.86 -29.99 67.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.173 -0.921 . . . . 75.540000000000006 112.128 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.695 HD12 ' HA ' ' A' ' 17' ' ' LYS . 26.2 pt -84.61 -8.47 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.592 -0.443 . . . . 74.25 110.917 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.06 18.44 9.89 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.701 -0.761 . . . . 65.140000000000001 113.467 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -79.44 104.66 10.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.526 0.679 . . . . 74.010000000000005 109.732 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.426 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 13.0 p . . . . . 0 N--CA 1.442 -0.849 0 CA-C-N 114.945 -1.025 . . . . 74.409999999999997 110.881 -177.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 . . . . . 0 N--CA 1.457 -0.083 0 N-CA-C 109.64 -0.504 . . . . 75.439999999999998 109.64 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.866 ' HA ' ' HE3' ' A' ' 10' ' ' MET . 8.0 mmt -61.16 -40.34 93.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.067 0.46 . . . . 73.150000000000006 109.783 176.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -49.81 75.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.35 -0.841 . . . . 74.239999999999995 110.067 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.43 HD22 ' HB3' ' A' ' 33' ' ' ASN . 10.4 m-80 -57.04 -44.23 82.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.097 -0.501 . . . . 52.119999999999997 110.835 177.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.617 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 56.3 t80 -61.36 -52.25 65.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.849 -0.614 . . . . 74.030000000000001 110.578 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.81 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 50.7 mm-40 -61.62 -37.54 84.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.763 0.316 . . . . 62.420000000000002 110.797 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -65.27 -42.34 93.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.272 -0.422 . . . . 64.239999999999995 110.105 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 tp -68.05 -37.31 81.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.913 -0.585 . . . . 71.439999999999998 110.82 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.81 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 59.2 mtpt -55.42 -49.87 71.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.486 0.66 . . . . 73.030000000000001 109.408 172.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 21.3 t -59.72 -40.84 89.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.34 -1.3 . . . . 74.530000000000001 110.739 176.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.27 -37.72 88.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 120.904 0.383 . . . . 73.540000000000006 110.728 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.608 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 21.3 t -71.76 -40.64 69.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.785 0.661 . . . . 71.530000000000001 112.785 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -65.29 -17.0 64.15 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 119.826 -0.75 . . . . 73.129999999999995 110.439 178.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.407 ' HG3' ' HD3' ' A' ' 21' ' ' ARG . 85.6 mttt -97.76 -64.48 1.04 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.957 -0.565 . . . . 71.5 111.654 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -110.62 -5.9 14.96 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 73.329999999999998 111.938 -172.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.608 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 4.3 mpt_? 63.67 12.8 6.85 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.893 0.477 . . . . 63.109999999999999 110.759 -177.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.523 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 39.6 ttt180 -170.38 168.78 7.82 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.744 -0.836 . . . . 73.150000000000006 108.744 -171.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.64 ' HE2' ' HB2' ' A' ' 38' ' ' CYS . 8.3 p90 . . . . . 0 C--N 1.319 -0.74 0 CA-C-O 121.505 0.669 . . . . 73.549999999999997 109.89 174.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.43 ' HB3' HD22 ' A' ' 12' ' ' ASN . 77.3 m-20 . . . . . 0 CA--C 1.522 -0.098 0 CA-C-O 120.976 0.417 . . . . 73.209999999999994 110.524 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.605 ' HA ' ' HB2' ' A' ' 37' ' ' TRP . 94.1 mt -71.95 -27.35 62.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.054 -0.521 . . . . 71.239999999999995 110.408 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.6 -43.72 98.9 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 110.604 -0.999 . . . . 74.349999999999994 110.604 173.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.23 -28.91 61.14 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.025 -0.607 . . . . 63.100000000000001 111.606 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.605 ' HB2' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.94 -50.52 70.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.371 0.605 . . . . 64.219999999999999 109.52 174.07 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.64 ' HB2' ' HE2' ' A' ' 26' ' ' PHE . 48.6 t -64.73 -40.48 95.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.177 -0.92 . . . . 73.239999999999995 111.049 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 44.7 m170 -72.02 -54.72 9.04 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.943 0.349 . . . . 74.230000000000004 111.943 -175.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.1 m -63.99 -40.43 96.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.079 0.466 . . . . 75.019999999999996 111.148 -174.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.725 ' HG2' HD22 ' A' ' 50' ' ' LEU . 9.9 mt-30 -84.13 -11.24 56.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.105 -0.498 . . . . 43.539999999999999 111.686 -177.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.597 ' HB2' ' O ' ' A' ' 38' ' ' CYS . 6.1 tpt180 -62.45 -36.25 81.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.932 0.873 . . . . 74.319999999999993 109.291 174.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 71.6 tttt -73.63 -54.36 8.33 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.405 -1.27 . . . . 75.25 111.134 178.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.45 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.4 mmt -57.62 -38.42 74.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.996 -0.547 . . . . 71.230000000000004 112.021 -178.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 9.5 ptm180 -65.24 -32.39 74.03 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.995 0.426 . . . . 75.329999999999998 110.899 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.16 -43.8 50.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.42 0.629 . . . . 64.25 109.561 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.489 ' NE2' ' HG3' ' A' ' 49' ' ' LYS . 27.8 mt-30 -72.58 -30.13 64.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.09 -0.959 . . . . 72.219999999999999 111.831 -177.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.87 30.41 17.88 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.523 -1.031 . . . . 74.340000000000003 110.523 -171.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.858 ' HE2' ' HA ' ' A' ' 49' ' ' LYS . 10.2 mmpt? -102.35 -8.44 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 115.3 -0.45 . . . . 74.340000000000003 110.257 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.725 HD22 ' HG2' ' A' ' 41' ' ' GLN . 2.9 mt -63.33 139.02 97.51 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.603 -0.726 . . . . 74.510000000000005 109.51 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.688 ' HD2' HD23 ' A' ' 50' ' ' LEU . 56.5 Cg_endo -75.71 145.19 28.82 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.105 1.87 . . . . 73.540000000000006 112.337 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.1 -30.4 70.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.347 -0.842 . . . . 52.539999999999999 110.264 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.683 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.7 m-20 -59.73 -51.01 71.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.914 -0.584 . . . . 75.030000000000001 110.828 176.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.455 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 2.3 tmt_? -57.31 -38.23 73.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.096 0.474 . . . . 64.310000000000002 110.018 -179.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttt180 -64.6 -49.58 70.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.797 -0.638 . . . . 71.439999999999998 110.475 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 56' ' ' LEU . 4.3 tt -64.87 -40.02 94.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.352 -0.84 . . . . 74.409999999999997 110.13 -176.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.683 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.4 mt -55.12 -39.94 69.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 73.310000000000002 111.042 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 87.3 mt -61.85 -45.48 93.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.036 -0.529 . . . . 73.340000000000003 110.665 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -65.36 -33.42 75.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.972 0.415 . . . . 65.0 110.879 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.71 -36.14 75.65 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.929 -0.578 . . . . 74.340000000000003 111.16 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.682 HG22 ' HG2' ' A' ' 17' ' ' LYS . 19.5 pt -85.68 -26.57 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.594 -0.275 . . . . 62.439999999999998 111.524 176.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 109.97 33.85 2.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.548 -0.834 . . . . 60.5 112.797 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.602 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 77.8 t80 -72.31 135.21 45.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.877 0.37 . . . . 75.120000000000005 110.328 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 N--CA 1.445 -0.718 0 CA-C-O 121.55 0.69 . . . . 71.120000000000005 110.554 -179.046 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.473 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.145 0 N-CA-C 109.023 -0.732 . . . . 65.219999999999999 109.023 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 47.9 ttm -55.32 -33.81 63.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 54.009999999999998 110.871 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.36 -53.98 20.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.56 -0.745 . . . . 72.109999999999999 110.471 -177.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.465 ' ND2' ' HA ' ' A' ' 9' ' ' TRP . 8.3 p30 -77.11 -20.06 56.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.75 0.309 . . . . 75.239999999999995 111.077 -176.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -51.38 -43.78 61.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 74.219999999999999 110.137 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -62.91 -36.4 83.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.891 -0.595 . . . . 74.319999999999993 111.304 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.3 -44.1 92.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 73.030000000000001 111.237 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.445 ' O ' HD21 ' A' ' 16' ' ' LEU . 3.4 tt -79.14 -32.58 44.43 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.591 -0.892 . . . . 72.140000000000001 108.591 -176.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -51.38 -51.91 50.49 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.729 -1.123 . . . . 73.299999999999997 110.511 174.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 25.6 t -76.58 -34.62 58.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.495 -0.775 . . . . 74.540000000000006 110.685 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 3.1 t80 -66.0 -45.35 81.89 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.869 0.366 . . . . 73.319999999999993 110.861 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.549 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 7.7 p -65.75 -34.4 70.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.373 -0.376 . . . . 73.329999999999998 111.588 -176.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HD2' ' C ' ' A' ' 21' ' ' ARG . 5.6 ppt_? -79.43 -16.39 56.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.352 0.596 . . . . 74.340000000000003 110.325 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.8 tptm -89.31 -53.72 4.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.694 -0.685 . . . . 75.219999999999999 111.137 -174.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -115.57 -10.36 11.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.8 -0.182 . . . . 75.219999999999999 111.364 -178.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.549 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 64.16 93.45 0.06 Allowed 'General case' 0 CA--C 1.518 -0.286 0 O-C-N 123.667 0.604 . . . . 75.340000000000003 110.126 -170.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.652 ' HD3' ' O ' ' A' ' 64' ' ' VAL . 57.0 mtm180 65.92 -174.69 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 114.569 -1.196 . . . . 74.299999999999997 110.551 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.54 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 2.9 p90 . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.785 -0.643 . . . . 74.239999999999995 109.819 171.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.449 ' O ' ' HB2' ' A' ' 37' ' ' TRP . 6.9 p30 . . . . . 0 CA--C 1.53 0.174 0 N-CA-C 111.461 0.171 . . . . 64.519999999999996 111.461 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.43 -28.31 59.31 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.869 0.366 . . . . 53.32 110.807 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.16 -45.59 96.24 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.689 -0.767 . . . . 74.239999999999995 111.53 178.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.03 -29.31 59.03 Favored Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 111.143 -0.783 . . . . 65.310000000000002 111.143 176.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.449 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 2.7 t90 -58.16 -55.79 30.42 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.085 0.554 . . . . 73.219999999999999 110.508 178.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.32 -46.76 87.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 73.040000000000006 110.787 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.432 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.3 m80 -57.43 -46.21 83.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.122 -0.49 . . . . 75.5 112.013 -178.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.504 ' O ' ' HE1' ' A' ' 44' ' ' MET . 1.3 t -70.65 -35.08 72.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.018 0.437 . . . . 63.340000000000003 110.848 -175.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.547 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 3.0 mt-30 -86.42 -21.39 27.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.23 0.826 . . . . 70.219999999999999 113.23 -172.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -69.17 -22.75 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.095 -0.642 . . . . 75.120000000000005 109.494 174.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.424 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 2.8 tmmm? -73.45 -30.41 63.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.359 -0.837 . . . . 70.349999999999994 109.952 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.547 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 13.4 mmt -67.62 -33.83 75.77 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.744 0.307 . . . . 74.299999999999997 110.39 174.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.744 ' HB2' HD11 ' A' ' 50' ' ' LEU . 17.4 tpt180 -72.98 -39.06 66.41 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.519 -0.472 . . . . 75.099999999999994 110.389 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -56.93 -44.76 82.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.372 0.606 . . . . 72.209999999999994 109.602 173.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.462 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 47.7 mt-30 -64.83 -29.58 70.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.191 -0.913 . . . . 71.400000000000006 110.996 174.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.99 28.65 44.86 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.969 -0.634 . . . . 75.129999999999995 111.582 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.462 ' HG2' ' HB2' ' A' ' 47' ' ' GLN . 18.3 ptmt -113.16 0.42 14.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 73.239999999999995 111.025 -176.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.744 HD11 ' HB2' ' A' ' 45' ' ' ARG . 1.8 mt -58.81 139.94 86.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.81 -0.632 . . . . 75.409999999999997 110.207 179.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -82.23 158.63 17.56 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 122.672 2.248 . . . . 73.530000000000001 111.486 173.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -71.08 -31.8 68.28 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.07 -0.968 . . . . 73.510000000000005 110.643 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.6 -51.24 50.32 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.917 -0.583 . . . . 74.140000000000001 112.231 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.571 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 47.5 ttt-85 -60.92 -50.52 73.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.047 0.451 . . . . 74.150000000000006 110.451 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.408 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -64.89 -26.83 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.764 -0.653 . . . . 74.519999999999996 110.964 -178.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -77.11 -51.73 10.52 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.212 -0.449 . . . . 74.530000000000001 110.726 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.2 mp -58.99 -43.23 91.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.447 -0.342 . . . . 53.350000000000001 111.043 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.612 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 71.2 mt -62.24 -40.77 97.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 75.340000000000003 110.31 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.408 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 15.6 t70 -57.68 -41.18 81.09 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.861 -0.609 . . . . 75.129999999999995 111.105 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.433 ' N ' ' HD2' ' A' ' 60' ' ' LYS . 1.6 mptp? -77.31 -28.93 53.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.756 -0.656 . . . . 74.319999999999993 112.589 -173.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 16.1 pt -82.85 -14.34 11.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.269 -0.572 . . . . 71.140000000000001 110.89 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 112.16 23.52 5.48 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.37 -0.919 . . . . 37.5 113.532 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.612 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 32.6 t80 -88.58 103.8 16.24 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.344 0.592 . . . . 71.209999999999994 109.794 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.652 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 14.4 p . . . . . 0 N--CA 1.443 -0.791 0 CA-C-N 115.205 -0.907 . . . . 72.030000000000001 110.775 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.462 ' HZ2' HD11 ' A' ' 57' ' ' LEU . 6.2 t-105 . . . . . 0 C--O 1.228 -0.029 0 CA-C-O 120.908 0.385 . . . . 72.329999999999998 110.36 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 78.1 mmm -61.6 -29.88 70.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 74.049999999999997 110.42 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -78.26 -49.6 13.41 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.522 -0.763 . . . . 72.0 109.788 176.587 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.426 HD22 ' HB3' ' A' ' 33' ' ' ASN . 2.0 t-20 -52.74 -35.67 56.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.194 0.998 . . . . 74.200000000000003 111.164 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -52.87 -39.41 62.6 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.979 -1.009 . . . . 73.510000000000005 110.833 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -63.44 -43.24 97.97 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.139 0.274 . . . . 75.099999999999994 111.521 -177.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.52 -40.45 97.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.002 0.43 . . . . 73.519999999999996 110.771 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.9 tp -78.65 -45.36 21.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.439 0.638 . . . . 74.400000000000006 109.321 -173.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -51.05 -51.02 57.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.442 -1.254 . . . . 63.520000000000003 111.353 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.0 m -70.41 -38.28 74.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.251 -0.886 . . . . 71.129999999999995 111.029 -176.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -76.36 -44.98 34.05 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.446 -0.502 . . . . 72.109999999999999 111.092 -173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.669 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 54.5 t -61.4 -33.91 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 110.993 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -58.26 -29.26 65.65 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.112 0.482 . . . . 62.439999999999998 110.767 176.013 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -91.26 -61.58 1.63 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.225 -0.443 . . . . 62.43 111.703 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -101.59 -6.7 23.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.35 0.5 . . . . 71.299999999999997 112.35 -174.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.669 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 28.4 mmt180 68.43 -0.59 2.17 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.173 0.589 . . . . 71.109999999999999 111.684 -178.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 80.9 mtt180 -168.71 172.01 8.25 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.326 1.05 . . . . 74.349999999999994 108.722 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.478 ' HZ ' ' HB2' ' A' ' 38' ' ' CYS . 10.2 p90 . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 121.345 0.593 . . . . 74.25 110.332 172.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.426 ' HB3' HD22 ' A' ' 12' ' ' ASN . 15.0 m120 . . . . . 0 N--CA 1.461 0.098 0 CA-C-O 120.729 0.3 . . . . 72.450000000000003 111.792 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.9 -38.76 69.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.415 -0.357 . . . . 74.230000000000004 111.756 -173.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.95 -43.74 96.6 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.923 -0.656 . . . . 51.009999999999998 111.889 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.19 -34.77 54.49 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.382 -0.687 . . . . 70.400000000000006 111.382 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.52 ' HH2' HD21 ' A' ' 58' ' ' LEU . 9.0 t90 -54.34 -52.22 62.26 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.31 0.576 . . . . 72.430000000000007 109.831 174.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.478 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.1 t -62.49 -46.33 88.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.937 -1.029 . . . . 72.129999999999995 111.131 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -56.77 -45.56 82.04 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.832 0.308 . . . . 73.230000000000004 111.832 -177.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 91.6 m -65.07 -48.17 74.73 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.314 -0.403 . . . . 71.030000000000001 111.691 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -84.7 -24.41 28.95 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.217 0.821 . . . . 71.439999999999998 113.217 -170.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.408 ' C ' ' HD2' ' A' ' 42' ' ' ARG . 1.4 tmm_? -62.88 -33.34 75.09 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.731 -0.84 . . . . 73.040000000000006 108.731 173.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.45 ' HB3' ' O ' ' A' ' 40' ' ' THR . 62.3 tttt -61.88 -50.52 71.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.248 -0.887 . . . . 74.530000000000001 110.575 175.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.625 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.6 mmt -61.39 -34.0 74.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 75.319999999999993 110.848 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.02 -48.11 81.75 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.458 -0.571 . . . . 61.310000000000002 109.458 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.9 tttp -66.65 -49.32 66.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.287 -0.869 . . . . 74.129999999999995 111.054 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.429 ' NE2' ' HD3' ' A' ' 49' ' ' LYS . 26.5 mt-30 -60.79 -32.08 71.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.943 -0.571 . . . . 73.349999999999994 111.757 178.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.32 41.01 5.91 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.581 -0.819 . . . . 60.350000000000001 111.95 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.429 ' HD3' ' NE2' ' A' ' 47' ' ' GLN . 16.2 ptmt -133.31 11.47 4.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.014 0.435 . . . . 75.010000000000005 111.459 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.625 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 4.1 mt -64.79 141.24 98.28 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-N 115.88 -0.6 . . . . 74.400000000000006 109.808 175.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.69 134.84 31.42 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.72 2.28 . . . . 74.140000000000001 111.755 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -60.19 -39.48 86.7 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.378 -0.828 . . . . 72.319999999999993 109.942 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.626 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.8 m-20 -56.61 -43.72 80.45 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.729 -0.669 . . . . 65.430000000000007 110.44 176.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -62.5 -49.47 75.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.563 -0.744 . . . . 42.340000000000003 110.265 -178.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -51.73 -44.37 63.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.403 -0.817 . . . . 74.329999999999998 110.309 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.594 ' HA ' ' OD2' ' A' ' 59' ' ' ASP . 7.0 mp -64.7 -41.71 95.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 72.109999999999999 111.481 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.1 mt -53.19 -39.38 63.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.937 0.399 . . . . 65.540000000000006 110.648 178.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.579 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 4.3 mm? -68.48 -49.51 59.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.68 -0.691 . . . . 75.510000000000005 111.411 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.594 ' OD2' ' HA ' ' A' ' 56' ' ' LEU . 1.9 p30 -73.27 -20.56 60.8 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.154 -0.619 . . . . 73.109999999999999 111.03 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -65.86 -41.4 91.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.784 0.326 . . . . 74.450000000000003 111.407 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -84.61 -2.74 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 74.230000000000004 110.871 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.511 ' O ' ' HD2' ' A' ' 24' ' ' ARG . . . 97.23 22.89 15.79 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 120.76 -0.734 . . . . 37.57 113.609 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.579 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 72.1 t80 -75.05 133.31 41.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.473 0.654 . . . . 73.340000000000003 110.164 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 73.6 t . . . . . 0 C--N 1.316 -0.869 0 CA-C-N 115.058 -0.974 . . . . 72.420000000000002 110.715 -177.873 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.737 ' HH2' HH21 ' A' ' 54' ' ' ARG . 5.8 t-105 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.847 0.356 . . . . 72.329999999999998 110.429 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.819 ' HA ' ' HE3' ' A' ' 10' ' ' MET . 2.1 tpt -56.88 -37.57 71.54 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.229 0.538 . . . . 61.32 110.29 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.46 ' C ' ' HD2' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.63 -46.91 51.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.64 -0.709 . . . . 74.409999999999997 110.594 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -56.82 -35.48 68.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.961 0.41 . . . . 65.239999999999995 110.767 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.402 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 40.8 t80 -59.94 -50.71 72.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.002 -0.544 . . . . 75.25 109.896 176.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 6.4 mm-40 -63.87 -39.04 93.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.083 -0.508 . . . . 73.329999999999998 110.717 176.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -61.82 -37.05 82.96 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.611 . . . . 74.140000000000001 110.282 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.764 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.0 tt -76.65 -43.21 39.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 65.349999999999994 111.016 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 58.2 mtpt -55.99 -57.02 13.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.329 0.585 . . . . 72.430000000000007 110.552 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 36.9 p -57.99 -30.2 65.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.853 -1.067 . . . . 74.25 111.322 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.536 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 34.8 t80 -70.62 -49.63 45.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.346 . . . . 72.510000000000005 110.305 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.2 t -59.63 -37.93 73.11 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 N-CA-C 111.777 0.288 . . . . 75.349999999999994 111.777 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -74.71 -18.88 60.44 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.374 -0.53 . . . . 65.430000000000007 110.586 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 18' ' ' SER . 53.5 tttm -94.87 -46.38 6.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 64.25 111.335 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.402 ' CE2' ' HD3' ' A' ' 22' ' ' LYS . 64.7 m-85 -118.31 -19.69 8.83 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.148 -0.221 . . . . 73.25 111.33 -176.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.611 ' NH1' ' HA3' ' A' ' 62' ' ' GLY . 11.3 mmm180 65.85 98.5 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 O-C-N 123.778 0.674 . . . . 73.040000000000006 111.563 -178.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 71.29 163.4 0.26 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.936 -1.029 . . . . 75.25 110.962 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.563 ' HE2' ' HB3' ' A' ' 38' ' ' CYS . 8.4 p90 . . . . . 0 C--N 1.32 -0.687 0 CA-C-O 121.518 0.675 . . . . 74.400000000000006 110.81 175.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 . . . . . 0 CA--C 1.52 -0.189 0 CA-C-O 121.296 0.57 . . . . 72.230000000000004 109.717 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.764 HD11 ' HA ' ' A' ' 16' ' ' LEU . 57.2 mt -64.13 -33.68 76.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.213 -0.903 . . . . 72.430000000000007 111.155 -178.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -51.65 -43.22 53.29 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.934 -0.651 . . . . 72.329999999999998 111.985 172.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.04 -31.45 34.94 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.849 -0.691 . . . . 75.319999999999993 111.697 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -56.87 -50.54 72.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.901 0.382 . . . . 71.129999999999995 110.719 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.563 ' HB3' ' HE2' ' A' ' 26' ' ' PHE . 30.0 p -65.05 -30.34 71.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 72.519999999999996 111.118 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -63.61 -47.25 82.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.788 0.328 . . . . 73.439999999999998 111.08 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.55 HG23 ' HE1' ' A' ' 44' ' ' MET . 23.5 m -77.62 -20.86 53.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.205 0.526 . . . . 52.32 110.945 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.483 ' HG3' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -77.64 -25.82 50.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.553 -0.294 . . . . 70.239999999999995 110.972 179.667 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 12.3 mmt180 -54.1 -47.1 72.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.226 0.536 . . . . 71.209999999999994 109.599 172.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 40' ' ' THR . 28.1 tttp -51.54 -62.56 1.55 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.624 -1.171 . . . . 73.239999999999995 111.181 175.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.55 ' HE1' HG23 ' A' ' 40' ' ' THR . 11.8 mmt -55.81 -46.22 78.11 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.058 -0.519 . . . . 73.209999999999994 112.229 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.527 ' HB3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -65.13 -39.33 92.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.342 0.497 . . . . 74.120000000000005 112.342 -170.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.456 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 62.9 pttt -80.21 -19.19 47.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 75.310000000000002 110.4 -179.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -89.77 -14.86 33.64 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.445 -0.798 . . . . 75.329999999999998 110.876 178.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.92 27.49 68.71 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.833 -0.622 . . . . 52.409999999999997 112.297 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -100.53 -12.8 18.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.76 0.314 . . . . 73.409999999999997 110.748 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 1.035 HD22 ' HD2' ' A' ' 51' ' ' PRO . 0.5 OUTLIER -60.03 139.12 91.0 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.86 -0.609 . . . . 70.230000000000004 109.661 177.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 1.035 ' HD2' HD22 ' A' ' 50' ' ' LEU . 39.9 Cg_endo -73.28 127.92 12.39 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.303 2.002 . . . . 74.310000000000002 112.671 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.403 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 32.4 t-20 -59.39 -37.39 77.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.001 -0.999 . . . . 71.439999999999998 109.876 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -56.1 -48.58 75.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.569 -0.741 . . . . 64.209999999999994 111.306 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.737 HH21 ' HH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -71.14 -26.24 62.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.266 -0.424 . . . . 75.230000000000004 110.118 -175.187 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.403 ' HB3' ' O ' ' A' ' 52' ' ' ASN . 25.4 ttm-85 -61.84 -39.97 93.67 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.155 0.502 . . . . 73.420000000000002 109.792 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 mp -70.2 -32.14 69.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.595 -0.729 . . . . 63.030000000000001 110.76 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.72 -39.4 94.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.151 0.501 . . . . 75.439999999999998 109.8 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 82.3 mt -71.04 -33.43 70.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.842 -0.617 . . . . 54.32 110.17 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.49 -32.65 74.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 74.430000000000007 110.887 177.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -62.0 -40.44 95.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 73.450000000000003 111.608 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 11.2 pt -87.99 -12.38 10.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.855 0.359 . . . . 73.319999999999993 111.362 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.611 ' HA3' ' NH1' ' A' ' 24' ' ' ARG . . . 102.79 25.86 7.41 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.69 -0.767 . . . . 74.540000000000006 113.623 174.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.732 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 56.2 t80 -76.33 104.96 7.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.484 -0.561 . . . . 74.200000000000003 109.484 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 6.6 p . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 74.420000000000002 111.133 -175.907 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 108.823 -0.806 . . . . 73.420000000000002 108.823 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.5 ttm -58.09 -40.87 82.19 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.219 -0.446 . . . . 64.549999999999997 110.017 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -58.05 -55.84 29.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.391 -0.822 . . . . 73.450000000000003 110.098 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.99 -39.42 81.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.449 -0.796 . . . . 62.310000000000002 111.171 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -59.4 -47.96 83.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 75.310000000000002 110.824 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.31 -40.91 96.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.849 0.357 . . . . 61.219999999999999 111.119 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.662 ' HB3' HD22 ' A' ' 34' ' ' LEU . 16.5 mm-40 -62.67 -32.57 73.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.22 -0.446 . . . . 73.150000000000006 110.969 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.837 HD11 HD13 ' A' ' 58' ' ' LEU . 1.2 tt -84.79 -34.45 22.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.822 -0.807 . . . . 71.319999999999993 108.822 -178.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -55.38 -37.12 67.14 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.051 -0.977 . . . . 70.430000000000007 109.491 172.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -82.55 -27.65 31.49 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 73.129999999999995 110.951 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -75.27 -36.17 61.26 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.837 0.351 . . . . 75.5 110.843 -177.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.468 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 62.9 t -57.96 -38.02 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 73.329999999999998 110.276 173.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.526 ' O ' ' HD3' ' A' ' 21' ' ' ARG . 3.5 tmt_? -76.03 -24.86 55.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.233 0.539 . . . . 74.209999999999994 109.944 176.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.419 ' HG3' ' CD2' ' A' ' 23' ' ' TYR . 24.5 tptm -71.66 -60.54 2.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.656 . . . . 75.5 111.482 -176.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.419 ' CD2' ' HG3' ' A' ' 22' ' ' LYS . 58.2 m-85 -126.15 3.96 7.15 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 63.219999999999999 112.196 -177.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.468 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 26.7 mmt-85 61.39 93.95 0.04 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.855 0.36 . . . . 74.209999999999994 110.802 -173.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.934 ' HG2' ' H ' ' A' ' 26' ' ' PHE . 40.2 ttt180 58.73 -169.57 0.13 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.618 -0.719 . . . . 74.349999999999994 109.927 -174.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.934 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.442 -0.843 0 CA-C-O 120.746 0.307 . . . . 73.349999999999994 110.253 170.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.835 0.35 . . . . 74.140000000000001 111.233 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.662 HD22 ' HB3' ' A' ' 15' ' ' GLU . 2.7 mm? -64.25 -28.55 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 74.450000000000003 111.062 -176.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -55.87 -44.77 87.36 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 74.420000000000002 112.062 174.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -83.08 -28.0 38.76 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.682 -0.771 . . . . 65.5 112.177 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.429 ' CH2' ' HG2' ' A' ' 41' ' ' GLN . 16.5 t90 -57.87 -50.55 72.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.707 -0.246 . . . . 73.219999999999999 111.02 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.41 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 26.8 p -59.85 -40.97 90.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.228 -0.442 . . . . 61.409999999999997 110.756 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -59.02 -46.1 89.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 73.530000000000001 110.73 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -76.16 -40.17 53.23 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.771 -0.65 . . . . 73.209999999999994 111.259 -175.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.429 ' HG2' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -78.7 -22.56 46.5 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.882 0.327 . . . . 54.020000000000003 111.882 -175.156 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.43 ' C ' ' HD3' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -65.64 -33.22 75.39 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.702 -0.481 . . . . 73.0 109.702 176.379 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -58.42 -52.49 65.4 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.04 -0.527 . . . . 72.430000000000007 109.971 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.706 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 9.6 mmt -58.56 -33.35 69.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.335 -0.848 . . . . 74.040000000000006 110.657 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.95 -39.94 75.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.689 -0.687 . . . . 71.340000000000003 110.197 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -72.24 -48.5 42.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.876 -0.602 . . . . 55.119999999999997 110.698 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -63.56 -22.22 66.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.658 -0.701 . . . . 73.230000000000004 111.747 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 76.25 29.92 57.75 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.682 -0.771 . . . . 64.239999999999995 111.479 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -113.75 3.15 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.8 0.333 . . . . 74.200000000000003 110.45 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.706 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 2.6 mt -59.65 138.26 89.78 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.689 -0.687 . . . . 72.510000000000005 109.376 175.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.467 ' HD2' HD22 ' A' ' 50' ' ' LEU . 81.5 Cg_endo -84.62 149.45 11.35 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.218 1.945 . . . . 64.439999999999998 112.333 176.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -70.98 -27.44 63.71 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.15 -0.932 . . . . 75.430000000000007 109.976 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.55 -51.7 68.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 40.299999999999997 110.433 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.464 ' O ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -63.87 -38.54 91.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 73.319999999999993 110.309 179.513 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -61.67 -45.94 91.87 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.038 -0.528 . . . . 61.100000000000001 110.563 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.3 tp -68.71 -42.27 77.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.387 -0.37 . . . . 71.319999999999993 111.55 -177.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.36 -39.46 79.61 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.737 0.303 . . . . 73.25 110.86 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.837 HD13 HD11 ' A' ' 16' ' ' LEU . 4.3 mm? -71.14 -43.31 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.24 0.543 . . . . 74.450000000000003 110.765 177.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.92 -28.55 69.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 71.239999999999995 110.231 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -74.61 -30.13 61.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 70.219999999999999 112.373 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.743 HD12 HD11 ' A' ' 58' ' ' LEU . 27.2 pt -87.72 1.47 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 120.519 -0.472 . . . . 74.040000000000006 111.101 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.88 16.31 31.19 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.449 -0.881 . . . . 73.319999999999993 113.021 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.55 105.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.062 0.458 . . . . 74.409999999999997 109.799 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.5 HG11 ' HB2' ' A' ' 25' ' ' ARG . 7.4 p . . . . . 0 N--CA 1.446 -0.645 0 CA-C-N 115.419 -0.81 . . . . 72.310000000000002 110.413 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.427 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 19.1 t-105 . . . . . 0 C--O 1.225 -0.209 0 N-CA-C 109.88 -0.415 . . . . 74.409999999999997 109.88 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.4 ttm -61.6 -37.73 84.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.146 -0.479 . . . . 72.239999999999995 110.482 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -56.93 -51.55 68.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.37 -0.832 . . . . 71.120000000000005 111.532 -178.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.402 HD22 ' HA ' ' A' ' 9' ' ' TRP . 11.1 p30 -78.18 -27.22 47.93 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.774 -0.37 . . . . 73.519999999999996 110.792 178.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -58.58 -46.05 87.78 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.492 -0.322 . . . . 74.329999999999998 111.351 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -65.16 -35.18 80.28 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 45.32 111.233 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.73 -33.66 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.278 0.561 . . . . 72.329999999999998 109.932 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.858 HD22 HD13 ' A' ' 58' ' ' LEU . 47.0 tp -80.89 -39.93 25.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.347 -0.842 . . . . 72.400000000000006 109.537 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -55.6 -43.61 76.2 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.719 -1.128 . . . . 74.219999999999999 110.19 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.4 m -72.04 -34.93 69.17 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.492 -0.776 . . . . 72.319999999999993 110.425 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.638 ' HA ' ' HD2' ' A' ' 22' ' ' LYS . 32.0 t80 -71.82 -41.34 68.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 74.5 110.964 -175.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.68 -39.29 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.446 -0.343 . . . . 74.349999999999994 110.137 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -24.69 67.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.417 0.627 . . . . 73.400000000000006 109.847 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.638 ' HD2' ' HA ' ' A' ' 19' ' ' PHE . 42.0 mttm -77.53 -68.97 0.57 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.561 -0.745 . . . . 75.530000000000001 111.599 -178.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 45.8 m-85 -120.86 -15.24 8.37 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.027 -0.269 . . . . 75.530000000000001 111.518 -171.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 23' ' ' TYR . 1.1 mpp_? 70.72 111.53 0.06 Allowed 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 123.947 0.78 . . . . 73.430000000000007 110.789 -171.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.49 ' HG2' ' H ' ' A' ' 26' ' ' PHE . 22.0 ttt180 71.55 -178.25 0.21 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.724 -1.126 . . . . 75.430000000000007 110.23 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.49 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 3.6 m-85 . . . . . 0 C--N 1.33 -0.24 0 N-CA-C 111.541 0.2 . . . . 64.109999999999999 111.541 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 . . . . . 0 CA--C 1.519 -0.24 0 N-CA-C 108.904 -0.776 . . . . 65.340000000000003 108.904 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.523 HD23 ' HB2' ' A' ' 16' ' ' LEU . 88.9 mt -66.06 -30.23 70.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.952 -1.022 . . . . 65.129999999999995 111.248 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -53.73 -40.93 64.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.058 -0.591 . . . . 64.510000000000005 112.151 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.47 -32.33 31.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.778 -0.725 . . . . 71.099999999999994 111.626 176.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.657 ' CZ2' ' HD3' ' A' ' 54' ' ' ARG . 26.2 t90 -54.15 -55.27 29.36 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.178 0.591 . . . . 72.239999999999995 111.126 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 7.1 p -67.12 -30.79 70.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.788 -0.642 . . . . 73.299999999999997 111.624 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -67.35 -36.47 81.47 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.763 0.282 . . . . 73.430000000000007 111.763 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.0 m -72.08 -45.08 62.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.156 0.503 . . . . 53.299999999999997 110.885 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.47 ' HG2' HD21 ' A' ' 50' ' ' LEU . 19.3 mt-30 -80.68 -10.46 59.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.119 -0.491 . . . . 74.209999999999994 111.458 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -56.27 -28.89 60.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.597 0.713 . . . . 75.209999999999994 109.429 171.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -88.08 -58.24 2.64 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.723 -1.126 . . . . 61.420000000000002 111.076 177.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.4 mmt -56.7 -33.02 66.04 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.747 -0.661 . . . . 75.329999999999998 112.105 -172.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.631 ' HA ' HD13 ' A' ' 50' ' ' LEU . 4.0 tmm_? -58.1 -50.53 73.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.324 -0.398 . . . . 75.109999999999999 111.115 -175.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -81.73 -16.59 50.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.011 0.434 . . . . 74.230000000000004 111.158 -174.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -99.65 3.64 45.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.141 -0.481 . . . . 74.230000000000004 111.483 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 64.0 27.17 70.94 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 120.779 -0.724 . . . . 75.349999999999994 112.315 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.713 ' HE2' ' HA ' ' A' ' 49' ' ' LYS . 10.3 mmpt? -99.34 -6.52 27.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.158 0.504 . . . . 73.200000000000003 109.85 -178.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.767 HD22 ' HD2' ' A' ' 51' ' ' PRO . 2.2 mt -62.32 141.02 96.4 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 115.161 -0.927 . . . . 72.510000000000005 110.258 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.767 ' HD2' HD22 ' A' ' 50' ' ' LEU . 64.5 Cg_endo -76.75 154.89 34.73 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.801 2.334 . . . . 62.119999999999997 112.997 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -71.76 -54.24 10.85 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.047 -0.979 . . . . 63.43 112.012 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.11 -34.88 64.06 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.023 0.44 . . . . 74.129999999999995 110.874 -175.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.657 ' HD3' ' CZ2' ' A' ' 37' ' ' TRP . 3.0 tmm_? -56.37 -42.85 78.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.403 -0.817 . . . . 73.510000000000005 110.134 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -67.0 -47.25 72.04 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 120.579 -0.448 . . . . 73.340000000000003 110.694 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.66 -39.82 91.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.931 -0.577 . . . . 53.149999999999999 110.993 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.1 mp -67.08 -37.05 83.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.109 -0.496 . . . . 72.319999999999993 110.958 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.858 HD13 HD22 ' A' ' 16' ' ' LEU . 3.8 mm? -67.78 -35.63 79.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.216 0.531 . . . . 65.510000000000005 110.411 176.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -64.51 -37.23 86.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.93 -0.577 . . . . 61.009999999999998 110.628 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -72.18 -31.88 66.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 74.209999999999994 112.19 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.778 HD13 HD11 ' A' ' 58' ' ' LEU . 25.1 pt -84.41 -12.92 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.598 -0.441 . . . . 62.409999999999997 110.751 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.28 34.85 4.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 72.530000000000001 113.534 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.416 ' CG ' HD12 ' A' ' 58' ' ' LEU . 81.0 t80 -74.49 126.51 30.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.893 0.378 . . . . 73.099999999999994 110.27 177.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.6 p . . . . . 0 N--CA 1.447 -0.595 0 CA-C-N 115.887 -0.597 . . . . 73.099999999999994 110.708 -178.042 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.417 ' CH2' ' HD3' ' A' ' 54' ' ' ARG . 22.7 t-105 . . . . . 0 N--CA 1.457 -0.093 0 N-CA-C 110.182 -0.303 . . . . 71.439999999999998 110.182 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.838 ' HA ' ' HE3' ' A' ' 10' ' ' MET . 2.5 tpt -55.73 -41.04 73.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.999 -0.546 . . . . 51.549999999999997 110.812 178.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -67.33 -53.8 26.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 73.219999999999999 110.392 -178.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -61.25 -32.04 71.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 65.239999999999995 111.172 -179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.448 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.8 t80 -63.43 -41.3 98.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 73.150000000000006 110.24 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.462 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 35.1 mm-40 -62.47 -42.19 99.3 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.476 -0.329 . . . . 72.5 110.508 178.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.504 ' HB3' HD12 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -60.96 -49.63 76.66 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.168 0.509 . . . . 62.200000000000003 110.37 174.052 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.42 HD23 ' CD1' ' A' ' 58' ' ' LEU . 27.0 tp -56.4 -51.63 67.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.205 -0.907 . . . . 74.540000000000006 111.611 -177.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 49.4 mtpt -50.92 -54.28 25.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.226 0.536 . . . . 63.229999999999997 110.705 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.635 ' O ' ' HD3' ' A' ' 22' ' ' LYS . 13.4 t -62.43 -46.88 86.52 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.116 -0.947 . . . . 62.43 111.146 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.637 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 10.5 t80 -70.26 -43.24 70.91 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.627 -0.26 . . . . 74.140000000000001 111.544 -172.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.597 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 91.7 t -67.58 -38.44 80.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.987 -0.285 . . . . 70.439999999999998 110.821 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -59.46 -28.86 67.37 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.074 0.464 . . . . 75.239999999999995 109.935 176.684 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.635 ' HD3' ' O ' ' A' ' 18' ' ' SER . 5.1 mptp? -79.71 -66.83 0.82 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.87 -0.605 . . . . 63.399999999999999 111.586 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.417 ' CD2' ' HB3' ' A' ' 22' ' ' LYS . 85.1 m-85 -113.59 0.86 14.77 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.926 0.713 . . . . 75.340000000000003 112.926 -169.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.597 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 15.1 mmt85 64.52 9.28 4.92 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.006 0.522 . . . . 75.040000000000006 112.18 177.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.7 ptt180 -178.06 178.19 0.96 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.585 -0.524 . . . . 74.109999999999999 109.585 -174.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.637 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 8.9 m-85 . . . . . 0 C--N 1.326 -0.416 0 N-CA-C 109.411 -0.589 . . . . 72.150000000000006 109.411 173.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.401 HD22 ' HG2' ' A' ' 15' ' ' GLU . 29.8 p-10 . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.027 0.38 . . . . 73.030000000000001 112.027 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.557 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 95.3 mt -75.71 -34.48 60.38 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 112.685 0.624 . . . . 72.109999999999999 112.685 -173.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.03 -40.36 98.39 Favored Glycine 0 N--CA 1.451 -0.321 0 N-CA-C 111.559 -0.616 . . . . 73.299999999999997 111.559 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.15 -28.77 43.7 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.396 -0.907 . . . . 42.219999999999999 111.381 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.61 ' HH2' HD23 ' A' ' 58' ' ' LEU . 20.0 t90 -56.75 -55.86 28.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 71.140000000000001 110.914 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.518 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 8.3 p -63.4 -42.29 98.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.465 . . . . 70.030000000000001 111.152 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -65.2 -28.78 69.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.026 -0.533 . . . . 73.25 111.72 -177.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.5 m -83.86 -39.2 20.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.926 0.393 . . . . 65.0 110.835 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.61 -30.83 70.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.310000000000002 111.954 -178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -53.93 -38.86 65.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.1 0.476 . . . . 64.329999999999998 110.598 177.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.494 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 3.5 tmmm? -71.21 -37.06 72.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.579 -0.737 . . . . 74.420000000000002 111.035 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.5 mmt -62.5 -39.95 95.14 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.04 0.448 . . . . 73.340000000000003 110.655 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.482 ' N ' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -70.29 -48.36 57.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.615 -0.72 . . . . 74.140000000000001 110.55 -175.742 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.494 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 51.4 pttt -63.09 -24.95 68.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.123 0.487 . . . . 72.299999999999997 110.422 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -87.42 -1.33 57.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.863 -0.608 . . . . 74.150000000000006 111.169 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 58.74 30.92 66.57 Favored Glycine 0 N--CA 1.452 -0.269 0 CA-C-N 116.053 -0.521 . . . . 75.430000000000007 113.308 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.07 -0.8 11.03 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.607 -0.349 . . . . 73.510000000000005 111.501 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.747 HD22 ' HD2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -61.33 140.23 94.61 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.096 -0.502 . . . . 74.450000000000003 109.711 172.307 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.747 ' HD2' HD22 ' A' ' 50' ' ' LEU . 55.3 Cg_endo -73.83 150.21 43.88 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.23 1.954 . . . . 72.349999999999994 112.231 178.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -69.61 -30.19 67.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.42 -0.809 . . . . 72.230000000000004 110.36 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.645 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 6.4 m-20 -69.69 -51.78 31.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.547 -0.751 . . . . 74.219999999999999 109.846 -175.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.616 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -56.54 -53.53 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.963 -1.017 . . . . 74.319999999999993 111.147 179.147 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -65.69 -24.74 67.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.414 -0.357 . . . . 75.109999999999999 111.055 -176.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.99 -38.58 64.1 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.72 -0.474 . . . . 64.030000000000001 109.72 176.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 82.7 mt -59.34 -44.18 92.67 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.801 -0.636 . . . . 74.209999999999994 110.01 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.61 HD23 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -62.02 -43.01 99.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.665 -0.698 . . . . 71.120000000000005 110.876 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.42 -33.78 74.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.517 -0.311 . . . . 72.109999999999999 110.86 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -64.14 -41.24 97.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 73.420000000000002 111.418 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.428 HG13 HG13 ' A' ' 20' ' ' VAL . 13.1 pt -83.12 -5.95 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.884 0.374 . . . . 71.549999999999997 110.893 177.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.431 ' HA3' ' NH1' ' A' ' 24' ' ' ARG . . . 85.96 41.32 7.19 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.027 -0.606 . . . . 65.310000000000002 113.24 173.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.446 ' CG ' HD12 ' A' ' 58' ' ' LEU . 78.6 t80 -81.19 135.54 35.77 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.128 0.49 . . . . 74.049999999999997 110.856 178.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.5 t . . . . . 0 C--N 1.318 -0.796 0 CA-C-N 115.578 -0.737 . . . . 61.219999999999999 110.299 176.658 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.601 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.117 0 N-CA-C 108.913 -0.773 . . . . 75.030000000000001 108.913 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.826 ' HE2' ' HA ' ' A' ' 10' ' ' MET . 18.4 mmt -57.73 -34.78 69.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.551 -0.75 . . . . 74.310000000000002 111.419 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.515 ' HE3' ' OE1' ' A' ' 15' ' ' GLU . 18.8 ttpt -66.85 -52.93 37.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.392 -0.367 . . . . 65.099999999999994 110.059 178.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.45 -34.9 77.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.839 -0.619 . . . . 51.539999999999999 110.862 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -59.04 -50.24 74.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 71.209999999999994 110.519 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -63.98 -35.93 82.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.386 -0.37 . . . . 70.420000000000002 111.422 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.515 ' OE1' ' HE3' ' A' ' 11' ' ' LYS . 32.8 mt-10 -73.21 -34.86 66.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.472 -0.331 . . . . 73.019999999999996 110.745 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.699 HD22 HD23 ' A' ' 58' ' ' LEU . 39.4 tp -73.08 -42.28 63.18 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.732 -0.84 . . . . 73.549999999999997 108.732 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -52.2 -49.3 64.17 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.054 -1.43 . . . . 75.319999999999993 110.965 174.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -62.74 -38.06 89.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 54.210000000000001 110.501 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.35 -39.91 62.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.669 0.271 . . . . 74.349999999999994 111.247 -175.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.27 -34.37 66.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.94 0.4 . . . . 73.099999999999994 110.291 174.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -71.15 -39.22 72.08 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.987 0.422 . . . . 74.219999999999999 110.08 175.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -65.06 -61.2 2.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.594 -0.73 . . . . 74.239999999999995 112.463 -177.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -122.54 -7.28 8.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.005 0.372 . . . . 75.150000000000006 112.005 -171.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.428 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 2.6 mmm180 64.55 99.79 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 O-C-N 123.527 0.517 . . . . 73.340000000000003 109.904 -173.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.428 ' HB3' ' O ' ' A' ' 24' ' ' ARG . 74.7 ttt180 67.28 172.16 0.26 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.781 -0.645 . . . . 75.010000000000005 109.634 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 . . . . . 0 C--N 1.323 -0.579 0 N-CA-C 110.35 -0.241 . . . . 73.299999999999997 110.35 -179.913 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 121.18 0.514 . . . . 74.239999999999995 110.666 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.79 -24.75 59.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 71.340000000000003 110.335 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.78 -37.79 92.97 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.3 -0.864 . . . . 51.229999999999997 111.668 175.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.35 -33.34 53.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.493 -0.861 . . . . 53.509999999999998 111.663 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -63.88 -47.23 81.47 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.088 0.47 . . . . 74.340000000000003 110.637 -179.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.0 p -71.61 -30.21 65.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.196 -0.457 . . . . 73.349999999999994 111.28 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -53.33 -38.89 63.63 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.096 0.474 . . . . 75.209999999999994 110.891 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.3 m -73.28 -39.87 65.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 72.540000000000006 111.257 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.427 ' OE1' ' HD2' ' A' ' 54' ' ' ARG . 31.8 mt-30 -85.41 -21.15 28.91 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.014 0.746 . . . . 75.439999999999998 113.014 -171.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.451 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -66.05 -27.91 68.45 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 65.140000000000001 109.497 175.012 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.451 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 16.4 mtpp -67.83 -50.45 56.62 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.233 -0.654 . . . . 74.519999999999996 109.233 172.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.689 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 18.1 mmt -55.39 -37.66 67.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.015 -0.993 . . . . 72.040000000000006 110.916 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.784 ' HB2' HD13 ' A' ' 50' ' ' LEU . 4.2 tmm_? -77.17 -41.24 42.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 64.430000000000007 110.749 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.47 -40.45 93.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.281 0.562 . . . . 74.349999999999994 109.633 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.456 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 4.3 tp-100 -70.52 -29.24 65.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.68 -0.691 . . . . 64.129999999999995 110.346 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.5 35.8 9.17 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.83 -0.7 . . . . 61.219999999999999 112.228 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.456 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 17.7 ptmt -124.24 3.51 8.52 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.57 0.211 . . . . 64.319999999999993 111.57 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.784 HD13 ' HB2' ' A' ' 45' ' ' ARG . 4.0 mt -62.38 140.29 96.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.026 -0.361 . . . . 73.099999999999994 110.026 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.691 ' HG2' ' HB3' ' A' ' 54' ' ' ARG . 66.5 Cg_endo -75.6 135.1 17.6 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.708 2.272 . . . . 55.539999999999999 111.862 175.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.53 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 27.8 p-10 -69.56 -24.74 63.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.826 -0.625 . . . . 72.420000000000002 111.414 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.605 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 29.1 m-20 -64.92 -51.77 60.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.758 0.313 . . . . 75.439999999999998 110.686 177.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.691 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -62.94 -42.1 99.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 74.430000000000007 110.37 175.48 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.53 ' HB3' ' HA ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -53.27 -40.8 64.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.593 -0.73 . . . . 71.109999999999999 111.017 172.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -69.13 -44.69 71.86 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.973 -0.38 . . . . 75.299999999999997 109.973 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 85.8 mt -55.22 -47.3 75.55 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.254 -0.43 . . . . 75.549999999999997 111.282 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.699 HD23 HD22 ' A' ' 16' ' ' LEU . 39.0 mt -71.52 -37.86 71.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.975 -0.557 . . . . 73.540000000000006 110.77 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -69.86 -24.53 63.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.208 -0.451 . . . . 74.310000000000002 110.908 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -42.81 70.74 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 116.062 -0.517 . . . . 73.430000000000007 110.446 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 15.4 pt -73.49 -33.86 40.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 120.914 0.388 . . . . 74.030000000000001 110.343 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 131.6 33.47 0.44 Allowed Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.454 -0.879 . . . . 72.430000000000007 113.368 173.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -87.17 102.45 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.29 0.566 . . . . 70.150000000000006 109.52 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.8 p . . . . . 0 N--CA 1.444 -0.734 0 CA-C-N 115.112 -0.949 . . . . 70.200000000000003 110.89 -175.837 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.363 0.125 . . . . 72.510000000000005 110.669 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.801 ' HA ' ' HE3' ' A' ' 10' ' ' MET . 20.0 mmt -60.4 -39.96 89.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.065 0.46 . . . . 74.420000000000002 110.89 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -69.5 -55.03 11.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 73.019999999999996 110.66 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -64.54 -33.35 75.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.706 -0.679 . . . . 73.400000000000006 111.933 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.441 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.7 t80 -59.08 -51.87 68.2 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 122.999 0.187 . . . . 74.420000000000002 110.503 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.799 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 73.6 mm-40 -59.6 -39.25 83.58 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.071 0.462 . . . . 73.109999999999999 111.016 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.516 ' CB ' HD23 ' A' ' 34' ' ' LEU . 52.8 mm-40 -66.15 -45.47 80.84 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 65.420000000000002 110.362 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.2 tp -62.98 -44.13 96.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.039 -0.528 . . . . 75.540000000000006 110.806 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.799 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.2 mtpt -50.99 -57.37 8.77 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.096 -0.502 . . . . 74.439999999999998 109.707 175.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -55.43 -42.76 74.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.049 -0.978 . . . . 61.119999999999997 111.951 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -62.67 -48.26 80.08 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.908 0.385 . . . . 65.239999999999995 111.353 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.712 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 32.9 t -72.3 -43.64 64.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.496 0.554 . . . . 75.519999999999996 112.496 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 17' ' ' LYS . 8.3 ppt_? -64.45 -15.76 61.26 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.954 -0.699 . . . . 75.319999999999993 110.848 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -87.25 -72.71 0.5 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.096 -0.502 . . . . 74.120000000000005 111.082 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -116.41 -6.87 11.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.32 0.489 . . . . 72.430000000000007 112.32 -170.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.712 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 12.1 mpt_? 66.05 13.71 9.23 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.851 0.46 . . . . 74.099999999999994 111.209 -176.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.7 ptt180 -161.94 175.61 11.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.586 0.231 . . . . 72.329999999999998 110.745 -175.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 73.099999999999994 110.744 175.969 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 . . . . . 0 CA--C 1.52 -0.174 0 N-CA-C 110.598 -0.149 . . . . 71.409999999999997 110.598 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.516 HD23 ' CB ' ' A' ' 15' ' ' GLU . 3.7 mm? -65.52 -32.01 73.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 74.450000000000003 110.642 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.19 -38.94 96.45 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.012 -0.614 . . . . 64.129999999999995 111.756 177.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.78 -31.53 35.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.33 -0.938 . . . . 74.219999999999999 111.561 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -58.79 -53.1 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.348 0.259 . . . . 75.420000000000002 111.063 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.7 p -62.25 -40.67 96.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.386 -0.37 . . . . 74.120000000000005 111.164 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -62.24 -45.58 92.67 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.871 0.367 . . . . 71.409999999999997 110.796 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.46 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 27.5 m -66.65 -38.38 86.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.894 -0.594 . . . . 73.109999999999999 110.856 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.574 ' HG3' HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.93 -20.95 60.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.108 -0.497 . . . . 71.310000000000002 111.513 -177.169 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -59.78 -43.9 94.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.729 0.299 . . . . 70.140000000000001 110.473 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -64.78 -41.54 95.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.318 -0.401 . . . . 75.030000000000001 110.097 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.536 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 25.3 mmt -57.77 -41.55 82.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.905 -0.589 . . . . 74.430000000000007 110.414 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.551 ' C ' ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -69.84 -49.68 50.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.698 -0.683 . . . . 73.209999999999994 111.045 -178.604 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -75.88 -22.5 56.08 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.881 -0.328 . . . . 73.430000000000007 111.324 -173.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.52 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 17.7 tt0 -85.3 -8.72 58.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.041 0.448 . . . . 74.430000000000007 110.19 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.18 37.62 63.55 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.695 -0.684 . . . . 60.409999999999997 112.409 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 14.2 ptmt -131.95 12.45 4.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.058 0.392 . . . . 74.310000000000002 112.058 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.574 HD23 ' HG3' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -63.43 135.32 96.2 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 108.527 -0.916 . . . . 75.019999999999996 108.527 176.391 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.743 ' HG2' HH11 ' A' ' 54' ' ' ARG . 20.5 Cg_exo -69.12 138.79 40.75 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.835 2.356 . . . . 74.109999999999999 113.109 -177.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.483 ' HA ' ' HG2' ' A' ' 55' ' ' ARG . 89.1 m-20 -69.51 -31.07 69.09 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.842 -1.072 . . . . 74.010000000000005 110.136 176.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.606 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 13.1 t70 -71.26 -47.9 54.26 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.531 -0.759 . . . . 74.120000000000005 110.144 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.743 HH11 ' HG2' ' A' ' 51' ' ' PRO . 3.2 ttm105 -61.95 -42.73 99.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 64.030000000000001 111.12 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.483 ' HG2' ' HA ' ' A' ' 52' ' ' ASN . 18.4 ptp180 -66.44 -31.92 72.97 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 109.745 -0.465 . . . . 72.239999999999995 109.745 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.16 -37.97 75.33 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.255 -0.429 . . . . 74.329999999999998 110.216 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.5 mt -59.84 -38.83 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 72.430000000000007 110.391 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.431 HD11 ' O ' ' A' ' 54' ' ' ARG . 9.9 mp -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 75.420000000000002 110.655 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.33 -36.56 82.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.814 0.34 . . . . 63.43 110.793 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -67.59 -40.01 84.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 74.040000000000006 111.671 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.437 HG21 ' HG2' ' A' ' 17' ' ' LYS . 33.6 pt -76.31 -14.03 14.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 120.579 -0.448 . . . . 65.510000000000005 110.877 178.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 110.74 20.16 7.42 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.624 -0.798 . . . . 61.409999999999997 113.582 173.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -68.32 130.67 43.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.299 0.571 . . . . 74.340000000000003 110.603 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.441 -0.879 0 CA-C-N 115.203 -0.908 . . . . 73.019999999999996 109.801 179.817 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.58 ' HZ2' ' HA ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.504 0 N-CA-C 109.897 -0.408 . . . . 72.329999999999998 109.897 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.446 ' SD ' ' N ' ' A' ' 10' ' ' MET . 1.5 mpt? -60.78 -38.15 84.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.992 -0.549 . . . . 75.439999999999998 110.762 -177.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.538 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.7 OUTLIER -69.95 -48.45 58.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.79 -0.641 . . . . 75.439999999999998 109.939 179.767 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -63.95 -35.83 81.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.996 -0.547 . . . . 64.340000000000003 110.673 178.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -61.62 -54.94 36.2 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 115.737 -0.665 . . . . 71.439999999999998 110.135 -177.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -62.57 -29.57 70.68 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.885 -0.326 . . . . 74.519999999999996 111.321 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 46.0 mt-10 -65.31 -39.46 92.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.054 0.454 . . . . 72.099999999999994 110.312 175.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -87.66 -35.14 18.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.765 -0.652 . . . . 74.430000000000007 109.734 -173.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -58.68 -47.73 83.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.527 -0.76 . . . . 64.530000000000001 110.568 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.3 t -69.97 -26.94 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.919 -0.582 . . . . 73.319999999999993 110.202 178.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.477 ' HE1' ' HA ' ' A' ' 26' ' ' PHE . 37.9 t80 -75.14 -52.26 11.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.175 -0.466 . . . . 73.109999999999999 110.547 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.605 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 8.2 p -62.85 -33.79 62.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 73.109999999999999 111.984 -176.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -76.17 -20.07 57.87 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.005 -0.434 . . . . 75.319999999999993 111.001 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.423 ' HD3' ' CE2' ' A' ' 23' ' ' TYR . 62.9 tttm -95.49 -55.32 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.647 0.261 . . . . 75.230000000000004 111.069 -179.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.423 ' CE2' ' HD3' ' A' ' 22' ' ' LYS . 84.6 m-85 -93.84 -18.9 21.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.715 0.265 . . . . 65.040000000000006 111.715 -173.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.605 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 30.3 mmm180 64.0 87.07 0.11 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.489 0.662 . . . . 74.329999999999998 110.618 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER 68.89 176.19 0.27 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.417 -1.265 . . . . 72.409999999999997 111.208 -173.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.635 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 81.7 m-85 . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.529 -0.759 . . . . 73.439999999999998 110.455 175.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.6 t30 . . . . . 0 N--CA 1.463 0.208 0 CA-C-O 120.677 0.275 . . . . 50.439999999999998 111.654 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.635 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 87.3 mt -60.81 -37.74 82.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.342 -0.39 . . . . 75.310000000000002 111.655 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.74 92.17 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.983 -0.627 . . . . 74.319999999999993 112.014 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.68 -38.96 12.73 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.719 -0.753 . . . . 72.299999999999997 111.68 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -55.17 -42.34 73.05 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 122.779 0.431 . . . . 71.430000000000007 111.097 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.1 t -65.98 -39.41 90.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.034 -0.53 . . . . 62.409999999999997 110.553 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -70.31 -37.26 74.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 72.230000000000004 111.727 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.6 m -68.93 -45.31 71.15 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.134 0.492 . . . . 74.540000000000006 110.838 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.715 ' HG3' HD23 ' A' ' 50' ' ' LEU . 2.8 mp0 -75.89 -17.24 59.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.085 -0.507 . . . . 71.310000000000002 111.588 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.5 tpt85 -59.87 -34.98 73.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.385 0.612 . . . . 72.010000000000005 109.863 173.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -74.14 -48.25 30.65 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.134 -0.939 . . . . 74.209999999999994 111.086 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.698 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.3 mmt -63.25 -29.57 70.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.885 -0.598 . . . . 72.439999999999998 110.987 -177.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -61.32 -50.39 73.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.836 -0.62 . . . . 74.400000000000006 111.172 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 46' ' ' LYS . 20.4 ptmt -77.2 -18.47 57.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.047 0.451 . . . . 71.310000000000002 111.038 -175.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -84.75 -13.77 50.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.099 -0.5 . . . . 73.219999999999999 110.492 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.99 25.49 75.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.926 -0.654 . . . . 72.310000000000002 112.176 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.447 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.0 ptmt -109.99 -0.95 17.91 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.104 0.478 . . . . 73.420000000000002 110.303 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.715 HD23 ' HG3' ' A' ' 41' ' ' GLN . 4.7 mt -62.2 140.79 96.17 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.59 -0.732 . . . . 72.150000000000006 109.917 175.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.48 ' HB2' ' HB3' ' A' ' 54' ' ' ARG . 23.9 Cg_exo -65.83 127.27 17.49 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.303 2.002 . . . . 75.120000000000005 110.747 172.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -59.04 -33.7 71.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.828 -0.623 . . . . 64.129999999999995 110.63 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.651 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 30.8 m-20 -65.5 -46.71 78.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.199 -0.455 . . . . 73.219999999999999 110.023 175.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.58 ' HA ' ' HZ2' ' A' ' 9' ' ' TRP . 31.8 tpt85 -56.42 -33.48 65.87 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.082 0.467 . . . . 74.239999999999995 110.869 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -73.15 -38.93 66.06 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.337 -0.392 . . . . 73.409999999999997 110.843 176.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.7 tp -76.34 -40.15 52.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.581 -0.281 . . . . 62.109999999999999 111.194 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 63.3 mt -59.31 -33.72 71.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.93 0.395 . . . . 74.540000000000006 111.042 -178.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.507 ' HG ' ' NH1' ' A' ' 54' ' ' ARG . 3.2 mm? -71.97 -43.86 64.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 71.340000000000003 110.446 176.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.039 -0.528 . . . . 70.209999999999994 110.26 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 59.7 mmtt -53.04 -46.94 68.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.467 -0.788 . . . . 70.230000000000004 110.991 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 7.4 pt -89.87 1.83 7.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.701 -0.681 . . . . 72.319999999999993 111.887 -174.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.21 24.44 8.95 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.323 -0.941 . . . . 51.43 113.666 174.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.446 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 34.9 t80 -89.41 101.45 14.13 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.535 -0.913 . . . . 74.140000000000001 108.535 173.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 C--N 1.318 -0.782 0 CA-C-N 115.281 -0.872 . . . . 62.039999999999999 111.916 -171.77 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 . . . . . 0 CA--C 1.524 -0.054 0 N-CA-C 110.14 -0.318 . . . . 72.120000000000005 110.14 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.826 ' HA ' ' HE3' ' A' ' 10' ' ' MET . 2.5 tpt -63.54 -34.92 78.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.101 0.477 . . . . 74.329999999999998 110.182 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.86 -48.21 39.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 73.400000000000006 110.556 -178.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -67.55 -39.47 84.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 64.349999999999994 111.465 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -62.83 -42.78 99.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.117 -0.233 . . . . 74.329999999999998 110.834 -176.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.99 -42.75 97.1 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.084 0.469 . . . . 64.109999999999999 110.869 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.99 -36.61 82.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.688 -0.687 . . . . 74.140000000000001 110.57 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 tp -81.96 -33.84 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 72.340000000000003 109.903 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -57.11 -52.05 66.85 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.699 -0.682 . . . . 70.319999999999993 109.999 175.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 m -68.51 -31.08 70.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.328 -0.851 . . . . 74.510000000000005 110.84 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -70.44 -50.63 36.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.428 -0.351 . . . . 64.209999999999994 110.316 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.607 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 71.8 t -68.74 -36.88 76.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 CA-C-N 116.634 -0.257 . . . . 63.030000000000001 111.078 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -31.61 72.91 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.676 -0.41 . . . . 75.299999999999997 110.89 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -94.41 -54.32 3.58 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.934 0.346 . . . . 74.299999999999997 111.934 -175.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -97.57 -9.38 27.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.605 0.24 . . . . 72.420000000000002 111.417 -175.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.607 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 25.5 mmt180 55.78 79.97 0.15 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.84 -0.618 . . . . 72.510000000000005 111.558 -174.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.727 ' HD3' HG13 ' A' ' 64' ' ' VAL . 22.6 mtt180 70.25 171.74 0.31 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.13 -0.941 . . . . 72.439999999999998 111.017 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 1.3 p90 . . . . . 0 C--N 1.324 -0.517 0 CA-C-O 121.235 0.54 . . . . 75.400000000000006 110.474 172.656 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.2 m120 . . . . . 0 N--CA 1.467 0.416 0 CA-C-O 120.848 0.356 . . . . 74.450000000000003 111.406 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.28 -33.47 73.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.533 . . . . 75.239999999999995 111.217 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.29 -49.79 73.92 Favored Glycine 0 CA--C 1.5 -0.869 0 C-N-CA 120.745 -0.74 . . . . 64.549999999999997 111.324 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.18 -31.24 71.81 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.561 -0.828 . . . . 43.229999999999997 111.139 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.638 ' HH2' HD23 ' A' ' 58' ' ' LEU . 7.7 t90 -56.17 -56.13 24.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.25 0.547 . . . . 74.450000000000003 109.954 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.3 t -71.19 -44.98 64.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.511 -0.768 . . . . 73.010000000000005 111.477 -177.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -57.68 -28.63 63.96 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.812 0.339 . . . . 73.140000000000001 111.635 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.1 m -84.38 -51.15 7.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.17 0.509 . . . . 71.019999999999996 111.162 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.49 ' HB3' HD12 ' A' ' 50' ' ' LEU . 61.1 mt-30 -76.6 -24.22 53.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.946 0.721 . . . . 74.349999999999994 112.946 -170.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.554 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 13.2 ttt180 -55.83 -42.53 75.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.474 0.654 . . . . 70.239999999999995 109.404 173.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -76.11 -32.13 59.03 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.577 -0.738 . . . . 61.119999999999997 110.075 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 14.8 mmt -60.53 -45.76 92.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.398 -0.364 . . . . 73.439999999999998 111.521 176.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.588 ' HB3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -65.58 -33.15 75.23 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.824 -0.35 . . . . 75.040000000000006 110.766 -177.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.445 ' HB2' HH11 ' A' ' 45' ' ' ARG . 5.2 tmmm? -73.87 -36.66 64.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.471 0.653 . . . . 72.540000000000006 109.53 176.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -73.56 -14.98 61.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.338 -0.846 . . . . 74.049999999999997 110.653 -178.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.616 ' C ' ' HE3' ' A' ' 49' ' ' LYS . . . 82.26 21.75 60.1 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.071 -0.585 . . . . 71.439999999999998 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.616 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 0.1 OUTLIER -95.09 -14.23 24.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.621 . . . . 41.299999999999997 110.535 -177.38 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.708 HD22 ' HD2' ' A' ' 51' ' ' PRO . 3.5 mt -93.6 141.74 24.25 Favored Pre-proline 0 C--N 1.315 -0.902 0 CA-C-N 115.315 -0.857 . . . . 73.540000000000006 110.248 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.708 ' HD2' HD22 ' A' ' 50' ' ' LEU . 83.7 Cg_endo -85.16 161.01 11.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.634 2.223 . . . . 65.439999999999998 111.736 170.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -71.35 -24.15 62.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.894 -0.594 . . . . 74.040000000000006 110.064 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.12 -51.75 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.734 -0.666 . . . . 74.239999999999995 111.192 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.4 ttm180 -67.87 -49.19 63.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.085 0.469 . . . . 74.209999999999994 110.376 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.519 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -50.41 -36.59 33.67 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.388 -0.824 . . . . 73.129999999999995 111.324 177.532 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.3 tp -68.35 -42.96 78.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 75.299999999999997 111.096 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.0 mp -62.35 -34.32 76.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.806 0.336 . . . . 72.219999999999999 110.869 178.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.638 HD23 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -65.65 -38.95 90.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.372 0.606 . . . . 71.109999999999999 110.473 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.519 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 12.4 t70 -64.94 -38.1 89.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.89 -0.595 . . . . 74.510000000000005 110.332 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -63.51 -41.7 98.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.775 -0.648 . . . . 74.319999999999993 111.969 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.452 HD13 HD11 ' A' ' 58' ' ' LEU . 35.3 pt -76.27 -16.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.563 -0.455 . . . . 63.009999999999998 110.906 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.67 33.6 3.28 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.731 -0.747 . . . . 45.539999999999999 112.984 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.42 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 48.0 t80 -93.79 133.78 36.81 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.072 0.463 . . . . 72.010000000000005 110.51 178.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.727 HG13 ' HD3' ' A' ' 25' ' ' ARG . 14.3 p . . . . . 0 N--CA 1.444 -0.749 0 CA-C-N 115.782 -0.644 . . . . 61.539999999999999 109.87 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.494 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 23.8 t-105 . . . . . 0 N--CA 1.462 0.17 0 N-CA-C 111.866 0.321 . . . . 70.120000000000005 111.866 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.895 ' HA ' ' HE1' ' A' ' 10' ' ' MET . 12.0 mmt -54.35 -37.82 65.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.088 0.47 . . . . 65.219999999999999 111.131 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -79.36 -49.09 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.965 -0.561 . . . . 71.099999999999994 110.243 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -52.71 -47.25 67.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.924 -1.035 . . . . 63.329999999999998 111.464 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -54.72 -51.94 64.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.861 -0.608 . . . . 74.349999999999994 110.934 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -66.72 -36.5 82.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 72.310000000000002 111.687 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.99 -36.53 69.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.178 -0.464 . . . . 74.409999999999997 110.631 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.437 ' O ' HD21 ' A' ' 16' ' ' LEU . 4.2 tt -77.36 -35.69 54.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.188 -1.041 . . . . 75.439999999999998 108.188 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.65 -42.09 74.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.785 -1.098 . . . . 63.039999999999999 110.395 174.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -74.85 -29.95 61.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.631 -0.713 . . . . 72.349999999999994 110.925 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -75.4 -46.18 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 73.349999999999994 111.435 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.548 HG13 ' HB ' ' A' ' 61' ' ' ILE . 8.1 p -65.25 -34.15 68.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.573 -0.285 . . . . 72.049999999999997 111.205 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -78.86 -16.42 57.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.137 0.494 . . . . 73.450000000000003 110.147 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -77.8 -67.43 0.73 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.805 -0.634 . . . . 74.150000000000006 110.986 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -116.86 12.98 14.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.621 0.23 . . . . 75.219999999999999 111.621 -176.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.509 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 16.1 mmt180 62.31 88.26 0.09 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.722 0.639 . . . . 72.409999999999997 110.733 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.414 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 tmt_? 70.57 166.0 0.29 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.581 -0.736 . . . . 73.310000000000002 109.317 -177.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.8 p90 . . . . . 0 C--N 1.32 -0.705 0 CA-C-O 121.151 0.501 . . . . 74.329999999999998 111.3 -179.72 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 . . . . . 0 CA--C 1.522 -0.111 0 N-CA-C 111.525 0.195 . . . . 72.340000000000003 111.525 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.1 mt -58.63 -42.56 88.54 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.738 0.304 . . . . 74.129999999999995 111.066 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -57.81 -42.99 94.84 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.078 -0.582 . . . . 74.340000000000003 111.956 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.79 -39.8 76.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.848 -0.691 . . . . 65.129999999999995 111.528 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -54.64 -48.97 71.63 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.483 -0.562 . . . . 73.430000000000007 109.483 176.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -64.07 -51.42 64.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.134 -0.939 . . . . 74.439999999999998 110.877 178.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -52.72 -44.71 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.363 0.505 . . . . 63.340000000000003 112.363 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 46.0 m -70.9 -45.23 64.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.158 0.504 . . . . 73.140000000000001 111.264 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.457 ' HB3' HD21 ' A' ' 50' ' ' LEU . 33.9 mt-30 -86.44 -12.58 48.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.764 1.024 . . . . 72.439999999999998 113.764 -171.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.74 -4.73 36.37 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.297 0.57 . . . . 74.340000000000003 109.952 174.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.711 ' HD3' ' HG3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -92.67 -47.78 6.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.504 -0.771 . . . . 73.239999999999995 108.982 172.299 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.744 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 12.5 mmt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.573 -0.739 . . . . 75.209999999999994 111.231 -175.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.645 ' HG3' ' N ' ' A' ' 46' ' ' LYS . 14.1 ptt180 -52.37 -49.34 64.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.991 -0.55 . . . . 74.450000000000003 111.519 -178.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.645 ' N ' ' HG3' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -82.2 -43.7 17.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.867 -0.606 . . . . 71.329999999999998 109.854 -175.513 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.711 ' HG3' ' HD3' ' A' ' 43' ' ' LYS . 10.9 mm-40 -60.91 -18.0 54.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.378 -0.828 . . . . 73.310000000000002 111.688 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.24 36.24 24.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.924 -0.655 . . . . 75.150000000000006 111.522 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.744 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 9.8 mmpt? -108.65 -10.25 15.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 71.5 110.066 -177.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.636 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 11.0 mt -75.38 142.6 75.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 74.109999999999999 111.226 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -70.92 137.92 33.06 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.745 2.296 . . . . 74.140000000000001 110.947 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.579 ' HA ' ' CG ' ' A' ' 55' ' ' ARG . 74.3 m-20 -63.82 -22.49 66.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.613 -0.721 . . . . 75.209999999999994 111.965 -177.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.756 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 20.2 m-20 -64.27 -52.74 57.18 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.445 -0.576 . . . . 64.329999999999998 109.445 179.179 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -63.8 -47.12 82.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.662 -0.699 . . . . 75.310000000000002 111.295 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.579 ' CG ' ' HA ' ' A' ' 52' ' ' ASN . 7.7 ppt_? -65.51 -23.65 66.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.003 0.43 . . . . 75.430000000000007 110.539 -175.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.6 tp -82.35 -37.43 25.68 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.816 -0.438 . . . . 62.200000000000003 109.816 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 41.4 mt -66.39 -43.75 84.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 73.200000000000003 110.538 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.7 mt -64.32 -44.07 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.128 -0.487 . . . . 73.150000000000006 110.621 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -68.88 -20.39 64.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.17 0.51 . . . . 75.109999999999999 110.353 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -79.55 -39.73 31.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.802 -0.635 . . . . 75.239999999999995 110.767 177.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.548 ' HB ' HG13 ' A' ' 20' ' ' VAL . 19.4 pt -80.99 -9.8 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.662 0.268 . . . . 72.030000000000001 111.366 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.76 6.44 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.624 -0.798 . . . . 43.049999999999997 112.816 175.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -84.07 120.48 26.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.09 0.471 . . . . 71.5 110.309 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--N 1.321 -0.652 0 CA-C-N 115.34 -0.845 . . . . 62.409999999999997 110.068 178.255 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.483 ' HZ2' HD13 ' A' ' 57' ' ' LEU . 11.7 t-105 . . . . . 0 C--O 1.224 -0.273 0 CA-C-O 121.298 0.57 . . . . 70.409999999999997 109.981 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.872 ' HA ' ' HE1' ' A' ' 10' ' ' MET . 15.2 mmt -66.1 -23.95 66.6 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.967 -0.561 . . . . 64.140000000000001 110.791 177.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 -51.49 9.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.065 -0.516 . . . . 74.109999999999999 110.379 179.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -78.1 -25.22 47.44 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.579 0.585 . . . . 71.329999999999998 112.579 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -62.46 -52.51 63.22 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 121.096 -0.242 . . . . 74.329999999999998 110.727 177.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 10' ' ' MET . 8.4 pt-20 -68.45 -25.26 64.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.349 0.595 . . . . 74.450000000000003 110.157 177.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -68.66 -31.83 71.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.363 -0.835 . . . . 70.349999999999994 109.844 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.542 HD22 ' CZ3' ' A' ' 37' ' ' TRP . 41.2 tp -88.81 -39.27 14.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.312 0.577 . . . . 75.510000000000005 109.571 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.543 ' HG3' HG23 ' A' ' 61' ' ' ILE . 59.2 tttm -53.29 -51.85 60.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.888 -1.051 . . . . 74.25 111.284 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.6 p -61.14 -33.53 73.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.68 -0.691 . . . . 75.319999999999993 111.463 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.538 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 14.5 t80 -75.38 -49.67 18.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.847 0.356 . . . . 75.129999999999995 110.389 -178.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.9 t -63.17 -36.18 74.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.177 -0.465 . . . . 63.420000000000002 110.666 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -53.83 -30.39 45.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.07 -0.514 . . . . 72.540000000000006 110.954 178.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -92.33 -56.03 3.19 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.879 -0.6 . . . . 73.140000000000001 112.042 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.94 -29.15 11.6 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 120.874 0.369 . . . . 65.540000000000006 111.113 -171.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.568 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.1 OUTLIER 62.3 104.28 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.218 -0.901 . . . . 71.209999999999994 110.192 -164.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.5 mmt180 77.79 153.3 0.14 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.572 -1.195 . . . . 73.409999999999997 111.625 -177.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.538 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 6.5 p90 . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 114.627 -1.169 . . . . 72.140000000000001 109.054 177.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 CA--C 1.519 -0.216 0 CA-C-O 121.329 0.585 . . . . 71.329999999999998 110.948 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 98.2 mt -74.37 -32.08 62.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.37 -0.832 . . . . 72.019999999999996 111.104 -174.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.486 ' HA2' ' HE2' ' A' ' 26' ' ' PHE . . . -61.19 -43.57 99.23 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.335 -0.936 . . . . 64.010000000000005 111.218 177.032 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.37 -30.73 66.61 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 110.986 -0.845 . . . . 60.210000000000001 110.986 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.7 ' O ' HG22 ' A' ' 40' ' ' THR . 2.1 t90 -63.79 -46.44 85.17 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.441 -0.577 . . . . 74.430000000000007 109.441 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.475 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.3 t -60.1 -45.42 93.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.089 -0.505 . . . . 74.530000000000001 110.324 176.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.41 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 74.4 m-70 -61.52 -32.43 72.48 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.277 -0.419 . . . . 73.329999999999998 111.988 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.701 ' O ' ' HG2' ' A' ' 44' ' ' MET . 1.3 t -71.05 -39.28 72.36 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 120.438 -0.505 . . . . 75.019999999999996 110.049 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.18 -27.57 61.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.859 0.361 . . . . 62.439999999999998 110.646 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.41 ' HB3' ' O ' ' A' ' 39' ' ' HIS . 21.3 tpt180 -54.98 -44.23 74.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.67 -0.695 . . . . 70.209999999999994 109.435 171.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 40' ' ' THR . 20.7 mtpp -71.79 -57.03 4.7 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.09 -0.959 . . . . 75.230000000000004 110.406 177.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.701 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.0 mmt -54.63 -33.99 61.42 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.808 -0.633 . . . . 71.049999999999997 111.973 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.856 ' HB2' HD11 ' A' ' 50' ' ' LEU . 23.9 tpt180 -74.14 -47.98 32.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.738 0.304 . . . . 65.140000000000001 110.334 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.475 ' HB3' ' HE2' ' A' ' 46' ' ' LYS . 5.1 tmmm? -64.99 -29.95 70.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.173 0.511 . . . . 72.540000000000006 110.162 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -79.23 -20.72 47.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.843 -0.617 . . . . 74.0 110.647 176.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 77.34 49.76 7.17 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.684 -0.689 . . . . 43.210000000000001 113.165 176.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.616 ' HD2' ' SD ' ' A' ' 44' ' ' MET . 0.1 OUTLIER -143.32 11.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.951 0.405 . . . . 61.310000000000002 111.915 177.678 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.856 HD11 ' HB2' ' A' ' 45' ' ' ARG . 5.7 mt -69.78 140.97 89.46 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.06 -0.518 . . . . 71.349999999999994 110.329 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.479 ' HD2' ' CD2' ' A' ' 50' ' ' LEU . 76.8 Cg_endo -80.63 144.92 16.0 Favored 'Trans proline' 0 C--O 1.239 0.535 0 C-N-CA 122.805 2.336 . . . . 73.439999999999998 113.047 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -65.5 -44.72 86.16 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.846 -1.07 . . . . 73.340000000000003 111.749 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.69 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 8.6 m-20 -54.78 -52.5 62.4 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.313 -0.403 . . . . 74.549999999999997 111.528 -175.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.546 ' HB3' HH11 ' A' ' 54' ' ' ARG . 3.1 ttp-105 -57.01 -46.0 82.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 65.310000000000002 110.697 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.72 -50.15 69.02 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.041 -0.981 . . . . 73.019999999999996 109.968 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.1 tp -67.64 -34.38 76.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 73.030000000000001 111.618 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.69 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.4 mt -62.61 -31.86 72.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 75.299999999999997 110.874 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt -71.67 -36.98 70.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.065 0.46 . . . . 75.430000000000007 110.443 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.22 -33.93 72.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.211 -0.449 . . . . 72.310000000000002 110.545 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -69.42 -31.78 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 71.019999999999996 111.881 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.543 HG23 ' HG3' ' A' ' 17' ' ' LYS . 38.9 pt -86.81 -7.13 10.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.653 -0.419 . . . . 74.209999999999994 110.903 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.21 22.81 12.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.659 -0.782 . . . . 71.150000000000006 112.77 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -82.9 108.12 16.0 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.246 0.546 . . . . 74.530000000000001 110.104 178.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.1 p . . . . . 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 73.239999999999995 110.641 -178.764 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.64 ' HZ2' HD11 ' A' ' 57' ' ' LEU . 18.5 t-105 . . . . . 0 N--CA 1.46 0.04 0 CA-C-O 120.496 0.188 . . . . 75.430000000000007 111.278 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 45.2 ttm -58.25 -35.02 71.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.748 0.309 . . . . 73.200000000000003 110.875 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.457 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.6 tmmt? -69.36 -55.47 10.29 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.187 -0.46 . . . . 75.209999999999994 110.921 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.501 HD22 ' HA ' ' A' ' 9' ' ' TRP . 11.8 p30 -66.09 -32.69 74.29 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 120.513 -0.475 . . . . 75.230000000000004 111.206 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.597 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 36.3 t80 -63.71 -45.75 88.56 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.279 . . . . 74.329999999999998 110.672 -179.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 38.7 mm-40 -58.97 -35.1 72.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.812 0.339 . . . . 71.25 111.287 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -75.45 -40.03 58.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.257 0.551 . . . . 72.540000000000006 110.041 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.418 HD11 HD21 ' A' ' 34' ' ' LEU . 47.0 tp -64.5 -40.25 95.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.281 -0.872 . . . . 73.329999999999998 111.597 -178.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.597 ' HG3' ' O ' ' A' ' 13' ' ' TYR . 55.2 mtpt -51.32 -57.71 8.16 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.348 0.594 . . . . 65.510000000000005 110.388 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.1 m -63.06 -37.05 85.63 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.915 -1.039 . . . . 62.310000000000002 111.336 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.524 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 11.2 t80 -65.73 -47.16 76.27 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.932 0.396 . . . . 74.340000000000003 110.621 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 40.2 t -67.76 -34.37 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.207 -0.451 . . . . 72.420000000000002 111.193 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -69.76 -39.83 76.48 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 120.928 -0.309 . . . . 74.519999999999996 110.367 178.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.67 -52.59 11.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.391 . . . . 73.150000000000006 111.406 -174.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -96.31 -20.82 18.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.017 0.377 . . . . 74.349999999999994 112.017 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.628 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 18.8 mmt180 63.47 92.99 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 72.239999999999995 110.158 -169.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.628 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 15.1 ptt-85 61.18 169.84 0.1 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.542 -1.208 . . . . 74.010000000000005 111.298 -176.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.524 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 1.8 p90 . . . . . 0 C--N 1.323 -0.555 0 CA-C-O 121.517 0.675 . . . . 74.239999999999995 110.754 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 . . . . . 0 C--O 1.225 -0.214 0 CA-C-O 120.306 0.098 . . . . 71.209999999999994 110.769 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.418 HD21 HD11 ' A' ' 16' ' ' LEU . 81.1 mt -61.4 -38.93 88.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.816 0.341 . . . . 71.510000000000005 110.914 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.72 -42.97 96.63 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.895 -0.669 . . . . 72.040000000000006 112.358 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -82.21 -26.71 47.16 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.275 -0.964 . . . . 53.240000000000002 111.293 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.41 ' CZ2' ' HZ3' ' A' ' 9' ' ' TRP . 5.2 t90 -56.58 -56.43 21.47 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 122.951 0.5 . . . . 75.420000000000002 110.584 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.7 p -65.09 -37.06 86.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.839 -0.619 . . . . 74.310000000000002 111.579 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 24.1 m80 -73.62 -40.46 63.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 74.450000000000003 111.908 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.491 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 95.9 m -63.65 -38.07 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.006 0.431 . . . . 74.530000000000001 110.966 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.946 ' HG2' HD22 ' A' ' 50' ' ' LEU . 7.9 mt-30 -76.55 -9.62 58.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.237 -0.438 . . . . 64.140000000000001 112.089 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 39' ' ' HIS . 5.1 mpt_? -62.41 -38.98 91.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.658 -0.497 . . . . 75.430000000000007 109.658 171.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -72.37 -37.37 68.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.635 -0.711 . . . . 73.519999999999996 110.34 179.189 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.817 ' HA ' ' HE3' ' A' ' 44' ' ' MET . 16.9 mmt -71.32 -34.81 70.9 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 52.0 110.635 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.2 ttt-85 -63.89 -45.27 90.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.45 0.643 . . . . 64.109999999999999 109.635 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.6 tttp -61.93 -49.09 77.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.541 -1.209 . . . . 61.119999999999997 111.146 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -63.77 -31.07 72.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.703 -0.68 . . . . 60.439999999999998 110.352 177.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.89 32.24 15.41 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.745 -0.661 . . . . 71.129999999999995 112.712 176.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.5 ptmt -121.98 7.16 9.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.792 0.329 . . . . 61.240000000000002 111.025 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.946 HD22 ' HG2' ' A' ' 41' ' ' GLN . 4.6 mt -60.02 138.81 90.99 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.825 -0.625 . . . . 72.140000000000001 110.656 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 32.3 Cg_exo -61.08 131.86 38.94 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.183 2.588 . . . . 74.319999999999993 112.965 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.4 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 8.0 t30 -72.18 -39.66 68.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.355 -0.838 . . . . 64.310000000000002 111.374 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.677 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 50.7 m-20 -58.29 -53.83 53.83 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.148 0.499 . . . . 64.140000000000001 110.069 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.533 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -59.44 -39.82 84.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.254 -0.884 . . . . 75.030000000000001 110.738 176.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.4 ' HB3' ' O ' ' A' ' 52' ' ' ASN . 11.4 ttt180 -55.85 -50.32 70.92 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.931 -0.577 . . . . 71.209999999999994 110.6 177.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -67.81 -36.24 80.06 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.467 -0.788 . . . . 75.230000000000004 110.548 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.677 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 59.4 mt -62.19 -33.59 74.84 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.259 -0.428 . . . . 75.010000000000005 110.822 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 54' ' ' ARG . 56.8 mt -71.47 -41.35 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.138 0.494 . . . . 73.299999999999997 110.377 178.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.96 -32.01 73.53 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.132 -0.485 . . . . 72.409999999999997 110.257 177.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -58.87 -47.64 84.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.879 -0.601 . . . . 65.120000000000005 111.668 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.557 HG23 ' HG2' ' A' ' 17' ' ' LYS . 30.2 pt -77.71 -9.72 12.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.839 0.352 . . . . 74.430000000000007 111.488 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.25 14.09 19.39 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.537 -0.839 . . . . 65.5 113.53 174.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -72.57 124.19 24.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.834 -0.432 . . . . 74.430000000000007 109.834 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 115.929 -0.578 . . . . 74.409999999999997 110.831 -176.638 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.475 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 2.9 t-105 . . . . . 0 C--O 1.226 -0.176 0 CA-C-O 120.415 0.15 . . . . 73.209999999999994 111.057 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.823 ' HA ' ' HE1' ' A' ' 10' ' ' MET . 2.9 tpt -59.18 -41.03 87.5 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.25 0.548 . . . . 61.539999999999999 110.572 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -70.27 -57.86 4.4 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.257 -0.883 . . . . 73.129999999999995 110.791 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -54.38 -32.0 56.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.989 -1.005 . . . . 72.319999999999993 111.241 -179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.643 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 63.8 t80 -58.41 -55.27 37.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.23 -0.441 . . . . 61.240000000000002 110.655 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.767 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 68.2 mm-40 -64.5 -36.73 85.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 64.129999999999995 111.204 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.15 -45.73 83.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.151 -0.477 . . . . 72.340000000000003 110.09 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.22 -40.08 93.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 64.540000000000006 110.95 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.767 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.7 mtpt -52.95 -58.85 5.58 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.931 0.396 . . . . 62.539999999999999 110.438 177.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.6 m -62.36 -36.34 81.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.227 -0.897 . . . . 74.239999999999995 111.414 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.666 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 18.9 t80 -63.16 -48.38 78.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 74.340000000000003 110.461 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.574 ' HA ' ' H ' ' A' ' 25' ' ' ARG . 64.6 t -71.8 -38.69 66.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.421 . . . . 73.430000000000007 110.562 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -55.82 -46.4 78.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.698 -0.683 . . . . 70.409999999999997 111.632 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.19 -48.84 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.306 0.484 . . . . 71.299999999999997 112.306 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -100.32 -15.93 17.85 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.026 0.38 . . . . 75.409999999999997 112.026 -170.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.54 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 6.8 mmt180 65.08 95.28 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.678 0.611 . . . . 74.549999999999997 111.519 -175.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.574 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 50.86 -172.74 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.657 1.183 . . . . 65.299999999999997 112.577 178.265 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.666 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 59.8 m-85 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.08 -0.509 . . . . 64.25 110.78 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 . . . . . 0 C--O 1.233 0.237 0 CA-C-O 121.582 0.706 . . . . 75.519999999999996 109.442 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.429 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 93.5 mt -59.74 -32.87 70.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.858 -1.065 . . . . 74.319999999999993 110.817 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.14 -39.47 97.18 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.019 -0.61 . . . . 75.109999999999999 112.143 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.6 -33.59 47.01 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.179 -0.768 . . . . 75.409999999999997 111.179 178.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.8 ' HZ2' ' HD3' ' A' ' 54' ' ' ARG . 38.0 t90 -58.94 -55.17 38.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.159 -0.52 . . . . 74.209999999999994 110.388 175.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.39 -43.0 99.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.257 -0.883 . . . . 60.240000000000002 111.428 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.31 -41.6 63.09 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.914 0.339 . . . . 75.439999999999998 111.914 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.5 m -73.98 -51.19 16.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.145 0.497 . . . . 73.310000000000002 111.407 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.575 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 30.4 mt-30 -85.71 -12.98 49.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.713 1.005 . . . . 73.010000000000005 113.713 -167.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.42 ' HD2' ' C ' ' A' ' 42' ' ' ARG . 6.2 ppt_? -64.59 -24.5 67.62 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.626 0.727 . . . . 75.140000000000001 109.544 173.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -78.77 -46.36 19.02 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.093 -0.958 . . . . 74.209999999999994 109.824 176.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.575 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 12.2 mmt -60.69 -31.03 70.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.542 -0.754 . . . . 64.400000000000006 110.512 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.427 ' HB2' HD11 ' A' ' 50' ' ' LEU . 23.5 tpt180 -59.11 -45.75 90.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.469 -0.787 . . . . 65.030000000000001 110.623 174.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.441 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 0.4 OUTLIER -71.33 -43.89 66.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.076 -0.511 . . . . 73.549999999999997 109.651 -179.058 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.408 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 45.7 mt-30 -65.63 -14.32 60.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.608 -0.724 . . . . 74.329999999999998 111.791 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.29 26.53 73.34 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.155 -0.545 . . . . 64.439999999999998 112.444 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.8 ptmt -110.35 -4.58 15.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.826 0.346 . . . . 65.239999999999995 111.001 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.562 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 3.9 mt -58.9 140.99 86.22 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.835 -0.62 . . . . 75.409999999999997 109.933 174.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -69.81 131.26 20.79 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.881 2.387 . . . . 64.430000000000007 112.309 176.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.56 -33.97 72.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.399 -0.819 . . . . 73.540000000000006 111.001 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.714 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 19.1 m-20 -51.91 -53.46 40.64 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.483 0.658 . . . . 75.430000000000007 110.028 176.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.8 ' HD3' ' HZ2' ' A' ' 37' ' ' TRP . 33.1 ttm180 -68.14 -48.65 64.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.742 -1.117 . . . . 73.5 111.217 -179.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.403 ' C ' ' HD3' ' A' ' 55' ' ' ARG . 3.6 tmt_? -50.22 -41.48 50.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.518 -0.765 . . . . 71.040000000000006 110.987 176.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.38 -36.14 73.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.559 0.218 . . . . 74.230000000000004 111.119 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 75.6 mt -61.81 -43.14 99.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 53.039999999999999 110.698 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.23 -39.15 86.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.839 -0.619 . . . . 73.420000000000002 111.159 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.94 -28.83 64.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.103 0.478 . . . . 71.120000000000005 110.253 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.465 ' C ' ' HD2' ' A' ' 60' ' ' LYS . 0.4 OUTLIER -66.9 -46.21 75.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.932 -0.576 . . . . 72.400000000000006 110.279 178.922 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.494 HG22 ' HG2' ' A' ' 17' ' ' LYS . 42.6 pt -72.9 -23.07 20.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.551 -0.295 . . . . 73.030000000000001 110.966 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.89 32.4 3.09 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.508 -0.853 . . . . 63.229999999999997 112.933 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -74.79 130.23 39.09 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.031 0.443 . . . . 72.140000000000001 110.29 177.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 C--N 1.323 -0.568 0 CA-C-N 115.684 -0.689 . . . . 70.510000000000005 110.1 179.819 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.513 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.16 0 CA-C-O 120.755 0.312 . . . . 63.539999999999999 110.296 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.776 ' HE2' ' HA ' ' A' ' 10' ' ' MET . 1.9 tpt -55.37 -43.27 74.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 73.409999999999997 110.321 177.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -66.6 -44.22 82.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.182 -0.917 . . . . 62.299999999999997 110.366 -178.773 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -65.64 -33.04 74.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.236 0.541 . . . . 74.239999999999995 110.787 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.423 ' CE2' ' HD2' ' A' ' 17' ' ' LYS . 91.5 t80 -63.99 -53.48 49.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 73.519999999999996 110.901 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -63.16 -32.27 73.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.273 -0.421 . . . . 74.450000000000003 111.336 -176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 47.7 mt-10 -63.69 -42.4 97.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.821 0.343 . . . . 74.129999999999995 110.979 177.269 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.465 HD22 ' O ' ' A' ' 16' ' ' LEU . 4.4 tt -79.51 -36.19 38.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.898 -0.778 . . . . 64.420000000000002 108.898 -174.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HD2' ' CE2' ' A' ' 13' ' ' TYR . 61.1 tttm -53.75 -44.79 70.28 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.694 -1.139 . . . . 75.409999999999997 110.879 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 58.4 m -82.25 -32.95 29.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.851 -0.613 . . . . 71.010000000000005 111.33 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -64.83 -47.25 78.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.819 0.342 . . . . 71.010000000000005 110.921 -177.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.517 HG11 HD13 ' A' ' 61' ' ' ILE . 8.7 p -65.61 -33.77 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.274 -0.421 . . . . 72.310000000000002 110.511 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.488 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.76 -25.27 62.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.234 0.54 . . . . 61.329999999999998 109.9 179.564 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -93.17 -56.07 3.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.612 -0.722 . . . . 65.409999999999997 111.553 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -90.54 -15.93 29.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.159 -0.473 . . . . 75.510000000000005 111.567 -174.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 9.6 mmm180 58.34 88.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.878 0.736 . . . . 71.5 110.556 -174.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.514 ' HG2' ' N ' ' A' ' 26' ' ' PHE . 37.8 ttt-85 67.24 167.34 0.24 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.698 -1.137 . . . . 72.310000000000002 111.117 -176.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.514 ' N ' ' HG2' ' A' ' 25' ' ' ARG . 52.7 m-85 . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 109.075 -0.713 . . . . 74.340000000000003 109.075 174.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.845 0.355 . . . . 60.020000000000003 110.784 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.459 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 82.4 mt -66.73 -30.94 71.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 72.349999999999994 110.803 176.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.54 -36.66 91.76 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.793 -0.923 . . . . 70.340000000000003 110.793 174.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.21 -38.12 63.26 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.173 -0.771 . . . . 70.030000000000001 111.173 174.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -56.27 -49.24 74.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.907 -0.405 . . . . 75.230000000000004 109.907 174.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.76 -51.26 70.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.622 -0.717 . . . . 72.140000000000001 110.635 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -56.71 -46.85 81.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 74.219999999999999 111.232 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.557 ' O ' ' HG2' ' A' ' 44' ' ' MET . 51.7 m -61.84 -42.58 99.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.222 -0.445 . . . . 72.129999999999995 110.926 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.488 ' HG3' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.78 -27.05 68.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 51.439999999999998 111.744 -175.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -58.77 -36.99 75.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 71.400000000000006 110.217 177.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.426 ' CE ' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -84.07 -34.78 24.13 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.932 -0.307 . . . . 74.549999999999997 110.501 178.131 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.557 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.3 mmt -55.16 -38.94 68.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.269 -0.423 . . . . 74.209999999999994 111.413 -176.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.518 ' HB3' HD11 ' A' ' 50' ' ' LEU . 10.9 ptm180 -72.33 -34.5 68.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.728 0.299 . . . . 74.230000000000004 111.021 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.77 -30.41 59.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.231 -0.655 . . . . 73.319999999999993 109.231 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -77.25 -16.99 58.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.392 -0.822 . . . . 51.329999999999998 110.462 174.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 74.24 24.44 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.965 -0.561 . . . . 74.25 112.642 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -109.13 -3.04 17.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.646 0.26 . . . . 54.020000000000003 111.455 -177.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.848 HD22 ' HD2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -64.65 139.07 97.66 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.644 -0.502 . . . . 62.229999999999997 109.644 176.774 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.848 ' HD2' HD22 ' A' ' 50' ' ' LEU . 2.6 Cg_exo -78.56 124.22 6.28 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.678 2.252 . . . . 74.25 111.753 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -61.06 -31.14 70.8 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.612 -0.722 . . . . 54.439999999999998 109.835 175.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.716 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.2 m-20 -57.56 -52.39 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.495 -0.775 . . . . 65.230000000000004 109.671 174.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.462 ' HG3' ' CH2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -67.42 -31.88 72.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 74.420000000000002 110.119 -178.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -60.9 -43.91 97.88 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.307 -0.627 . . . . 72.420000000000002 109.307 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 65.8 tp -72.48 -41.91 65.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.0 -0.546 . . . . 73.519999999999996 110.508 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 79.1 mt -58.03 -43.31 86.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.845 0.355 . . . . 73.439999999999998 110.466 177.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.654 HD13 HD11 ' A' ' 61' ' ' ILE . 21.2 tp -64.77 -44.56 89.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.675 -0.693 . . . . 53.240000000000002 110.403 -178.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -63.19 -38.01 89.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.156 -0.475 . . . . 72.519999999999996 110.322 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -70.84 -36.55 72.95 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.906 -0.588 . . . . 75.319999999999993 111.997 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.654 HD11 HD13 ' A' ' 58' ' ' LEU . 10.7 pt -74.56 -3.66 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.758 0.313 . . . . 61.530000000000001 111.75 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.6 20.06 8.37 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.311 -0.947 . . . . 43.520000000000003 113.497 173.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -87.54 119.72 28.11 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.199 0.523 . . . . 75.239999999999995 110.559 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.473 ' CG1' ' HD2' ' A' ' 25' ' ' ARG . 14.4 p . . . . . 0 N--CA 1.442 -0.836 0 CA-C-N 115.473 -0.785 . . . . 54.350000000000001 110.293 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 7.3 t-105 . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.398 0.142 . . . . 73.140000000000001 111.199 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.736 ' HA ' ' HE2' ' A' ' 10' ' ' MET . 0.0 OUTLIER -59.84 -31.2 69.52 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.119 0.485 . . . . 52.5 110.381 -179.193 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.68 -48.24 15.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.924 -0.58 . . . . 73.150000000000006 110.058 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -65.28 -32.89 74.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 116.326 -0.397 . . . . 73.329999999999998 111.792 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -65.77 -53.31 42.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.822 0.344 . . . . 73.439999999999998 110.195 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.727 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 65.3 mm-40 -61.21 -31.98 71.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.302 0.572 . . . . 74.25 110.032 176.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.21 -52.24 63.06 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.081 -0.963 . . . . 74.540000000000006 110.095 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.4 tp -61.04 -44.72 96.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.725 -0.671 . . . . 70.209999999999994 111.133 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.727 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.9 mtpt -51.49 -58.42 6.32 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.501 0.667 . . . . 70.140000000000001 109.881 176.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.9 m -61.79 -42.53 99.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.562 -1.199 . . . . 73.140000000000001 111.838 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.47 ' CE2' ' HB3' ' A' ' 26' ' ' PHE . 26.4 t80 -67.18 -46.59 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.63 0.252 . . . . 75.299999999999997 110.799 -176.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 t -66.46 -39.38 83.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.957 -0.297 . . . . 73.400000000000006 110.678 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -60.94 -25.71 66.98 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.007 0.432 . . . . 71.530000000000001 110.203 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -92.77 -58.34 2.38 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.257 -0.429 . . . . 75.109999999999999 112.141 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -100.81 -30.04 11.92 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.207 0.447 . . . . 62.32 112.207 -170.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.3 OUTLIER 64.27 94.65 0.05 Allowed 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 123.846 0.716 . . . . 71.340000000000003 110.461 -168.379 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.2 mmm180 75.61 168.31 0.27 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 114.316 -1.311 . . . . 73.019999999999996 111.185 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.529 ' CZ ' ' HB3' ' A' ' 34' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.322 -0.594 0 CA-C-N 115.523 -0.762 . . . . 75.409999999999997 110.067 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 120.931 0.396 . . . . 71.430000000000007 111.183 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.529 ' HB3' ' CZ ' ' A' ' 26' ' ' PHE . 3.6 mm? -74.37 -26.68 60.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.143 -0.48 . . . . 75.109999999999999 110.709 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.88 97.74 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.61 -0.596 . . . . 73.109999999999999 111.61 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.57 -35.62 75.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.866 -0.683 . . . . 73.230000000000004 111.479 176.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -60.04 -49.81 76.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 74.209999999999994 109.946 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.1 m -70.33 -33.23 71.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.739 -0.664 . . . . 75.340000000000003 111.928 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -53.42 -37.08 62.21 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.799 0.333 . . . . 73.340000000000003 111.309 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 39.7 m -77.95 -44.55 26.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.893 -0.594 . . . . 65.120000000000005 111.369 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -84.84 -19.23 32.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.43 0.9 . . . . 61.409999999999997 113.43 -170.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.65 -26.75 68.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.126 0.489 . . . . 73.030000000000001 109.936 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -70.55 -45.48 65.39 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.526 -0.761 . . . . 65.219999999999999 109.631 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.759 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.5 mmt -65.94 -33.51 75.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.766 -0.652 . . . . 73.310000000000002 110.774 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.662 ' HB2' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -68.43 -47.05 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 73.510000000000005 110.082 178.76 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.41 ' HD2' ' O ' ' A' ' 46' ' ' LYS . 0.3 OUTLIER -63.54 -45.65 89.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.784 -0.643 . . . . 75.099999999999994 109.444 179.819 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.477 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 1.2 tp-100 -67.6 -31.01 70.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 72.540000000000006 110.909 -178.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.84 41.24 4.73 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.206 -0.521 . . . . 75.400000000000006 113.385 174.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.477 ' HE2' ' HB3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -131.96 2.62 4.01 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 117.212 0.506 . . . . 75.349999999999994 111.455 177.654 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.759 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 5.1 mt -54.24 140.0 54.96 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.721 -0.392 . . . . 73.340000000000003 110.434 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.6 140.52 81.7 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 123.262 2.641 . . . . 73.439999999999998 113.002 178.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.468 ' O ' ' HG3' ' A' ' 55' ' ' ARG . 18.1 m120 -64.3 -29.05 70.15 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.057 -0.974 . . . . 74.329999999999998 110.754 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -70.26 -44.27 68.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.066 0.46 . . . . 74.019999999999996 109.828 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' A' ' 54' ' ' ARG . 26.5 mmt180 -59.17 -51.8 68.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 71.25 110.987 177.314 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -66.02 -27.58 68.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.314 -0.403 . . . . 74.329999999999998 110.452 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.32 -44.2 30.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.711 0.291 . . . . 72.409999999999997 110.503 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.1 tp -59.46 -45.89 90.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.977 -0.556 . . . . 71.219999999999999 110.822 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 10.5 mp -66.05 -45.0 82.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.903 -0.589 . . . . 63.409999999999997 110.472 178.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.12 -28.25 69.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.287 0.565 . . . . 65.430000000000007 110.56 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -53.55 19.3 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 115.792 -0.64 . . . . 54.140000000000001 110.959 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.0 pt -68.49 -19.86 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.682 0.277 . . . . 74.329999999999998 111.728 -176.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.98 22.72 4.14 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.591 -0.814 . . . . 65.239999999999995 112.601 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.536 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 45.3 t80 -83.78 103.7 13.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.416 0.627 . . . . 74.519999999999996 109.723 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.444 -0.771 0 CA-C-N 115.059 -0.973 . . . . 73.25 110.044 -179.811 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.56 ' HZ3' ' HZ2' ' A' ' 37' ' ' TRP . 25.6 t-105 . . . . . 0 N--CA 1.461 0.114 0 N-CA-C 112.584 0.587 . . . . 75.310000000000002 112.584 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.885 ' HA ' ' HE1' ' A' ' 10' ' ' MET . 2.4 tpt -53.69 -39.03 64.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.235 0.54 . . . . 74.319999999999993 110.63 -177.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.499 ' HE2' ' HB3' ' A' ' 11' ' ' LYS . 4.5 tmmm? -75.42 -41.93 54.76 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.637 -0.71 . . . . 72.439999999999998 110.199 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -59.0 -38.8 80.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.831 -0.622 . . . . 75.319999999999993 111.092 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -60.93 -48.18 83.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 74.450000000000003 110.371 177.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.647 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 70.6 mm-40 -64.68 -38.97 92.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 71.140000000000001 110.697 178.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -60.28 -45.2 94.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.887 -0.597 . . . . 72.329999999999998 109.692 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.49 HD23 HD12 ' A' ' 58' ' ' LEU . 33.0 tp -58.95 -47.34 85.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 72.310000000000002 110.946 178.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.647 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.3 mtpt -54.99 -55.73 27.65 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.22 0.533 . . . . 71.530000000000001 110.765 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.8 t -55.74 -47.26 77.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.204 -0.907 . . . . 52.100000000000001 111.069 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.562 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 42.2 t80 -65.26 -46.78 79.13 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.274 -0.421 . . . . 74.109999999999999 111.292 -176.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 9.4 p -68.09 -32.56 56.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-N 116.311 -0.404 . . . . 62.43 110.896 -178.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.479 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.6 tmt_? -70.94 -19.08 62.61 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.199 0.524 . . . . 74.030000000000001 110.179 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -85.16 -61.51 1.75 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.939 -0.573 . . . . 65.519999999999996 111.445 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -97.13 -19.0 18.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.767 0.318 . . . . 75.319999999999993 110.777 -176.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.559 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER 60.81 93.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 65.340000000000003 110.546 -168.36 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.485 ' HD2' ' O ' ' A' ' 64' ' ' VAL . 63.0 ttt180 65.21 158.64 0.1 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.445 -1.252 . . . . 73.109999999999999 112.184 -172.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.562 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 11.2 p90 . . . . . 0 C--N 1.317 -0.829 0 CA-C-N 114.583 -1.19 . . . . 75.219999999999999 109.387 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.081 0.467 . . . . 51.329999999999998 111.055 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.485 HD11 ' HA ' ' A' ' 16' ' ' LEU . 3.1 mm? -75.13 -24.9 58.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.947 -0.569 . . . . 72.140000000000001 110.26 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.49 -36.16 92.77 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.658 -0.701 . . . . 36.399999999999999 112.022 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.42 -36.45 49.66 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.564 -0.827 . . . . 61.030000000000001 111.661 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.56 ' HZ2' ' HZ3' ' A' ' 9' ' ' TRP . 3.7 m95 -58.91 -49.88 76.14 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.032 0.444 . . . . 74.340000000000003 110.596 175.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -61.18 -40.21 93.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.314 -0.857 . . . . 73.310000000000002 111.174 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -69.8 -46.66 65.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.144 0.424 . . . . 65.340000000000003 112.144 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.463 ' O ' ' HG2' ' A' ' 44' ' ' MET . 49.0 m -80.99 -57.52 3.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.429 0.529 . . . . 54.340000000000003 112.429 -172.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.13 -18.46 49.75 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.535 0.939 . . . . 73.349999999999994 113.535 -166.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 42' ' ' ARG . 5.4 tmm_? -65.23 -32.12 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.194 0.521 . . . . 64.310000000000002 109.821 176.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.0 ttmm -76.51 -46.05 28.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.734 -0.666 . . . . 64.340000000000003 110.551 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.528 ' HB3' ' HG3' ' A' ' 49' ' ' LYS . 11.6 mmt -59.92 -28.75 67.87 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.54 -0.755 . . . . 71.340000000000003 111.273 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 ttt180 -64.88 -48.94 72.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.032 0.444 . . . . 73.140000000000001 110.463 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.503 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 3.3 tmmm? -65.76 -34.7 78.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.354 0.597 . . . . 54.350000000000001 109.619 -179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -83.74 1.03 44.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.518 -0.764 . . . . 63.140000000000001 111.704 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 59.25 34.45 80.15 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 116.356 -0.384 . . . . 72.019999999999996 113.232 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.528 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 17.9 ptmt -119.21 1.9 11.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.161 0.505 . . . . 70.420000000000002 110.967 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 mt -61.77 142.22 94.83 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.325 -0.852 . . . . 75.439999999999998 110.113 172.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.494 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 26.0 Cg_exo -64.65 120.69 8.03 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.177 1.918 . . . . 75.010000000000005 111.038 169.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -56.58 -32.86 65.63 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.98 -0.555 . . . . 73.310000000000002 110.42 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -58.31 -41.3 84.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 74.349999999999994 110.57 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.494 ' HG2' ' HB2' ' A' ' 51' ' ' PRO . 18.7 mmt180 -62.1 -50.2 72.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 116.088 -0.506 . . . . 74.439999999999998 110.799 179.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -54.24 -37.81 65.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.778 -0.646 . . . . 72.349999999999994 110.521 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 tt -68.38 -53.1 26.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 75.200000000000003 110.366 178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mp -60.71 -39.39 88.38 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.336 -0.393 . . . . 74.430000000000007 111.592 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.546 HD13 HD11 ' A' ' 61' ' ' ILE . 4.0 mm? -61.66 -40.09 93.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.996 0.427 . . . . 62.420000000000002 110.787 178.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -66.7 -35.74 80.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.278 -0.419 . . . . 72.329999999999998 110.595 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -64.51 -42.55 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 75.140000000000001 111.255 -178.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.546 HD11 HD13 ' A' ' 58' ' ' LEU . 6.8 pt -77.76 -17.05 14.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.741 0.305 . . . . 75.349999999999994 111.682 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 117.4 29.75 2.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.08 -1.057 . . . . 71.530000000000001 113.949 172.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -84.57 106.9 16.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.532 -0.544 . . . . 74.030000000000001 109.532 175.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.485 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 12.9 p . . . . . 0 C--N 1.322 -0.622 0 CA-C-N 115.626 -0.715 . . . . 61.450000000000003 110.892 -177.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.661 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 120.43 0.157 . . . . 75.549999999999997 110.844 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.445 ' HE2' ' HA ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -61.3 -38.01 85.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 72.030000000000001 109.705 175.775 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 25.1 ttmt -70.14 -49.42 50.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.493 -0.776 . . . . 70.019999999999996 110.097 174.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.463 ' HB2' ' HA ' ' A' ' 9' ' ' TRP . 74.1 m-20 -54.61 -46.4 73.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.19 -0.913 . . . . 75.25 111.511 -178.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.432 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 32.4 t80 -55.65 -48.0 75.71 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.923 -0.581 . . . . 65.349999999999994 112.039 -173.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 11' ' ' LYS . 17.1 pt-20 -68.78 -34.85 76.25 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.96 -0.296 . . . . 75.310000000000002 111.259 -175.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -76.03 -40.91 52.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.033 0.444 . . . . 75.310000000000002 110.121 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.554 HD23 ' CD2' ' A' ' 58' ' ' LEU . 38.2 tp -57.04 -54.17 49.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 74.109999999999999 111.723 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.601 ' HZ2' ' HB3' ' A' ' 17' ' ' LYS . 8.4 mtpm? -51.79 -52.47 48.76 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.426 0.631 . . . . 70.310000000000002 110.556 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.9 m -58.9 -44.62 91.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.506 -1.225 . . . . 71.299999999999997 111.597 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.675 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 7.8 t80 -67.41 -52.42 40.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 74.530000000000001 110.422 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 78.1 t -60.1 -33.91 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.426 . . . . 75.530000000000001 111.621 178.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 21' ' ' ARG . 1.6 tmt_? -61.41 -26.84 68.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.377 -0.374 . . . . 75.329999999999998 111.106 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -108.94 -52.8 2.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.458 -0.337 . . . . 73.310000000000002 111.379 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 88.4 m-85 -90.7 -15.61 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.749 0.278 . . . . 72.510000000000005 111.749 -174.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 63' ' ' PHE . 26.6 mmt180 75.06 -18.46 0.44 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.632 0.773 . . . . 74.420000000000002 112.861 -178.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 177.16 174.0 0.45 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.858 -0.423 . . . . 74.400000000000006 109.858 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.675 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 7.7 p90 . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 71.439999999999998 111.363 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t30 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.112 -0.699 . . . . 72.530000000000001 109.112 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.2 mt -63.64 -43.88 95.5 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.441 -0.8 . . . . 71.329999999999998 110.934 177.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -51.82 -42.5 53.24 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 120.838 -0.696 . . . . 37.829999999999998 112.743 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.94 -34.49 27.03 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.313 -0.946 . . . . 43.530000000000001 112.261 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.502 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 17.2 t90 -57.17 -49.26 76.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.983 -0.377 . . . . 75.120000000000005 109.983 177.191 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.657 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 42.3 t -58.34 -50.72 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.919 -0.582 . . . . 74.510000000000005 110.63 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -61.62 -37.51 84.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.929 -0.578 . . . . 74.530000000000001 112.257 -176.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 m -82.78 -36.28 25.79 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.902 0.382 . . . . 74.010000000000005 111.405 -177.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.78 ' HG3' HD21 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.58 -18.29 61.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 73.099999999999994 111.581 -176.447 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 38' ' ' CYS . 18.0 mmt180 -52.78 -47.63 67.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.354 0.597 . . . . 71.409999999999997 109.954 173.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 47' ' ' GLN . 1.2 tmmm? -70.29 -42.12 72.46 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.074 -0.967 . . . . 75.430000000000007 110.827 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.645 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.5 mmt -64.11 -35.85 82.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.233 0.54 . . . . 74.200000000000003 110.651 -177.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.576 ' CB ' HD13 ' A' ' 50' ' ' LEU . 2.2 tmm_? -69.42 -49.66 53.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.334 -0.848 . . . . 72.109999999999999 110.17 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.02 -31.58 68.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.157 -0.474 . . . . 65.420000000000002 110.646 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.508 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 4.1 tp-100 -72.74 -22.12 60.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.525 . . . . 70.319999999999993 110.575 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.42 37.52 27.39 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.728 -0.749 . . . . 64.439999999999998 111.98 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 19.2 ptmt -121.06 -1.3 9.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.189 0.519 . . . . 74.319999999999993 110.917 177.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.78 HD21 ' HG3' ' A' ' 41' ' ' GLN . 7.0 mt -68.97 142.58 93.5 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.768 -0.651 . . . . 64.430000000000007 110.09 172.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -73.67 138.32 26.35 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.0 2.466 . . . . 74.319999999999993 111.54 174.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -72.37 -34.8 68.22 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.161 -0.927 . . . . 75.109999999999999 112.457 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.615 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 36.0 m-20 -54.76 -51.86 64.38 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.872 0.367 . . . . 73.349999999999994 110.546 -177.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.661 ' HG3' ' CZ2' ' A' ' 9' ' ' TRP . 2.8 ttp85 -55.58 -38.88 69.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 70.510000000000005 111.301 177.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -59.8 -43.76 94.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.051 0.453 . . . . 72.409999999999997 110.539 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.33 -33.32 63.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.9 -0.591 . . . . 74.549999999999997 110.654 -177.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.2 mt -60.96 -36.45 79.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 73.230000000000004 110.633 177.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 54' ' ' ARG . 23.9 mt -63.61 -37.9 89.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 75.120000000000005 110.241 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.27 -25.91 68.26 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.942 -0.572 . . . . 74.420000000000002 111.187 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -36.19 56.06 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.405 -0.362 . . . . 73.409999999999997 110.932 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.4 pt -81.53 -12.22 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.82 0.343 . . . . 73.099999999999994 111.189 177.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.85 18.97 10.02 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.585 -0.817 . . . . 64.230000000000004 113.073 176.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.53 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 42.6 t80 -76.63 107.17 8.73 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.001 -0.74 . . . . 74.120000000000005 109.001 176.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.442 -0.866 0 CA-C-N 115.346 -0.843 . . . . 75.349999999999994 111.224 -175.36 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.478 0.974 0 CA-C-O 120.82 0.343 . . . . 74.340000000000003 110.361 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -114.58 -163.2 0.86 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.738 -0.467 . . . . 75.209999999999994 109.738 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -64.0 -46.7 83.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.793 -0.185 . . . . 71.209999999999994 110.698 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 59.98 -164.21 0.22 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.15 -0.477 . . . . 72.329999999999998 109.823 -177.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 74.7 mt -102.38 5.95 40.02 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.458 0.647 . . . . 73.430000000000007 109.478 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -97.92 37.77 1.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.155 -0.93 . . . . 63.109999999999999 111.171 -174.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -62.1 -37.73 94.95 Favored Glycine 0 N--CA 1.454 -0.15 0 C-N-CA 120.954 -0.641 . . . . 74.450000000000003 111.926 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -57.46 -48.85 78.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.79 0.328 . . . . 74.019999999999996 110.459 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.512 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 8.3 t-105 -56.01 -50.11 71.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.786 -0.643 . . . . 75.430000000000007 110.538 177.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.8 ' HA ' ' HE1' ' A' ' 10' ' ' MET . 2.7 tpt -56.64 -45.54 81.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.136 -0.483 . . . . 73.219999999999999 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmpt? -68.36 -45.21 73.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 73.340000000000003 110.798 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -69.62 -35.92 75.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.342 -0.39 . . . . 73.129999999999995 111.397 -177.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' A' ' 57' ' ' LEU . 44.4 t80 -59.29 -50.97 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.779 -0.191 . . . . 75.530000000000001 111.088 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.82 -25.05 64.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.817 0.342 . . . . 73.219999999999999 111.176 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.486 ' OE2' ' HG ' ' A' ' 34' ' ' LEU . 34.8 tt0 -72.18 -41.12 67.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 62.219999999999999 110.107 177.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.521 HD11 HD23 ' A' ' 34' ' ' LEU . 7.1 tt -79.94 -31.51 40.05 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.878 -0.786 . . . . 65.450000000000003 108.878 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.695 ' HA ' HD12 ' A' ' 61' ' ' ILE . 85.4 tttt -55.68 -49.78 72.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.194 . . . . 74.430000000000007 110.371 174.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 m -72.75 -31.08 64.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.44 -0.8 . . . . 74.239999999999995 110.793 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.624 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 29.3 t80 -70.81 -46.99 61.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 73.420000000000002 110.377 -178.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.868 HG21 ' H ' ' A' ' 25' ' ' ARG . 24.2 t -65.2 -34.27 69.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.358 -0.383 . . . . 65.109999999999999 111.688 177.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -58.5 -20.94 50.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.292 0.568 . . . . 72.109999999999999 109.983 175.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -100.48 -47.75 4.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.024 -0.535 . . . . 61.32 111.646 -176.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -111.49 -25.92 9.34 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.378 0.881 . . . . 74.329999999999998 113.378 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.843 ' HA ' HG13 ' A' ' 20' ' ' VAL . 3.0 mpt_? 60.21 92.03 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.908 -0.405 . . . . 70.319999999999993 109.908 -166.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.868 ' H ' HG21 ' A' ' 20' ' ' VAL . 33.3 ttt180 67.59 161.64 0.18 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.75 0.786 . . . . 73.049999999999997 111.548 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.624 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 5.7 p90 -130.0 87.25 52.2 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 64.400000000000006 110.513 -179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.19 -20.51 62.77 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 123.097 2.531 . . . . 73.420000000000002 113.001 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -87.38 -49.9 6.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.464 -0.335 . . . . 62.520000000000003 110.269 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.587 ' HG ' ' HA2' ' A' ' 35' ' ' GLY . 7.8 t 65.38 81.79 0.2 Allowed 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.461 -0.791 . . . . 75.0 111.002 177.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.4 p -139.06 17.5 2.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.799 -0.637 . . . . 64.519999999999996 110.885 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.487 ' H ' ' CD ' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -98.31 14.45 27.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.169 -0.468 . . . . 61.409999999999997 111.897 -173.848 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.59 -83.41 0.79 Allowed Glycine 0 CA--C 1.518 0.245 0 C-N-CA 121.013 -0.613 . . . . 54.539999999999999 113.893 173.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -65.04 -55.57 18.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.607 0.242 . . . . 65.239999999999995 111.269 -172.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.521 HD23 HD11 ' A' ' 16' ' ' LEU . 77.7 mt -66.96 -34.26 77.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.847 0.356 . . . . 73.530000000000001 110.141 178.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.587 ' HA2' ' HG ' ' A' ' 29' ' ' SER . . . -59.29 -43.15 97.49 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 64.230000000000004 112.181 178.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.36 -39.15 57.77 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.839 -0.696 . . . . 63.119999999999997 111.417 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.481 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 6.3 t90 -60.15 -42.53 95.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.91 0.386 . . . . 73.530000000000001 110.444 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.5 t -66.14 -38.83 89.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 74.510000000000005 110.888 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.6 m80 -59.25 -47.86 83.79 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 73.140000000000001 110.64 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.451 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 9.2 m -67.22 -35.1 78.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.204 0.526 . . . . 72.120000000000005 110.571 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.481 ' HB2' ' O ' ' A' ' 37' ' ' TRP . 3.2 tp-100 -65.12 -28.37 69.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.567 -0.742 . . . . 74.310000000000002 111.675 -174.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -54.77 -46.5 74.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 75.310000000000002 110.939 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.545 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -74.04 -22.53 59.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.062 -0.517 . . . . 73.409999999999997 110.717 -176.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.477 ' CB ' ' HG ' ' A' ' 50' ' ' LEU . 25.7 mmt -67.09 -46.25 74.83 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.412 -0.588 . . . . 73.319999999999993 109.412 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.528 ' HB2' HD12 ' A' ' 50' ' ' LEU . 8.1 tmm_? -75.48 -35.68 60.8 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.272 -0.876 . . . . 74.510000000000005 109.819 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.496 ' HB3' ' HA ' ' A' ' 43' ' ' LYS . 1.7 tmtp? -61.0 -47.3 87.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.88 -0.6 . . . . 74.540000000000006 110.706 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -75.4 -31.86 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.142 -0.481 . . . . 74.310000000000002 110.873 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.36 21.65 37.31 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.825 -0.702 . . . . 73.219999999999999 111.85 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.443 ' HD3' ' SD ' ' A' ' 44' ' ' MET . 13.8 ptmt -95.96 -5.1 42.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.095 0.474 . . . . 72.219999999999999 109.763 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.528 HD12 ' HB2' ' A' ' 45' ' ' ARG . 1.3 mt -57.43 138.95 81.03 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.047 -0.979 . . . . 63.450000000000003 110.163 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 3.5 Cg_exo -82.46 128.09 5.32 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.115 2.543 . . . . 71.5 111.191 174.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -61.13 -28.54 69.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.817 -0.629 . . . . 53.350000000000001 111.806 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -66.87 -46.11 76.0 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.071 0.463 . . . . 60.130000000000003 109.973 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.512 ' HG2' ' CH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -62.44 -41.57 98.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.005 -0.739 . . . . 73.109999999999999 109.005 176.267 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.571 ' HG2' ' CZ2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -62.0 -44.62 96.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.103 -0.953 . . . . 72.239999999999995 110.646 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.64 -41.99 74.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 73.120000000000005 111.724 -177.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HB3' ' CE1' ' A' ' 13' ' ' TYR . 5.9 mp -57.87 -43.07 85.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.709 0.262 . . . . 55.43 111.709 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.507 HD21 ' NH2' ' A' ' 54' ' ' ARG . 9.3 mp -71.6 -33.38 68.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 65.150000000000006 111.095 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.92 -38.37 90.73 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.225 0.535 . . . . 51.530000000000001 110.014 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -69.86 -29.99 67.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.173 -0.921 . . . . 75.540000000000006 112.128 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.695 HD12 ' HA ' ' A' ' 17' ' ' LYS . 26.2 pt -84.61 -8.47 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.592 -0.443 . . . . 74.25 110.917 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.06 18.44 9.89 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.701 -0.761 . . . . 65.140000000000001 113.467 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -79.44 104.66 10.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.526 0.679 . . . . 74.010000000000005 109.732 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.426 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 13.0 p -80.43 136.69 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 114.945 -1.025 . . . . 74.409999999999997 110.881 -177.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.571 ' CZ2' ' HG2' ' A' ' 55' ' ' ARG . 76.5 m95 -89.32 -29.01 19.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.948 -0.569 . . . . 75.109999999999999 109.98 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.3 m 65.18 -179.47 0.18 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.203 -0.908 . . . . 53.539999999999999 111.139 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.5 mt -110.5 83.49 1.77 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.384 0.611 . . . . 73.010000000000005 109.618 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -82.37 -38.68 23.82 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.884 -1.053 . . . . 74.230000000000004 109.346 -177.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -93.39 95.66 9.44 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.029 -0.987 . . . . 75.530000000000001 109.206 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -77.21 87.91 3.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.025 -0.534 . . . . 72.540000000000006 110.446 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -172.32 88.29 0.09 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.418 -0.81 . . . . 74.120000000000005 109.366 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -96.14 126.72 41.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.017 0.437 . . . . 74.299999999999997 110.213 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -87.38 -6.95 58.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.504 0.669 . . . . 63.32 109.255 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 53.0 t60 . . . . . 0 C--O 1.243 0.726 0 N-CA-C 108.288 -1.004 . . . . 74.239999999999995 108.288 175.333 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 109.774 -0.454 . . . . 75.540000000000006 109.774 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -152.7 37.7 0.52 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.035 -0.53 . . . . 63.210000000000001 109.744 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -59.42 104.46 0.27 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.765 -0.652 . . . . 61.5 111.186 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -88.64 173.11 8.8 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.828 -0.624 . . . . 72.230000000000004 111.113 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -96.22 76.81 3.03 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.341 -0.985 . . . . 71.040000000000006 108.341 170.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.432 ' C ' ' H ' ' A' ' 8' ' ' GLU . 56.1 tp60 -111.73 147.81 34.81 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.409 -0.814 . . . . 75.219999999999999 109.919 -174.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.0 29.81 1.84 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.098 -0.573 . . . . 44.229999999999997 112.157 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.432 ' H ' ' C ' ' A' ' 6' ' ' GLN . 6.3 tp10 -70.85 -13.47 62.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.876 -0.416 . . . . 51.32 109.876 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -62.95 -48.09 80.4 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.64 -0.504 . . . . 75.439999999999998 109.64 172.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.866 ' HA ' ' HE3' ' A' ' 10' ' ' MET . 8.0 mmt -61.16 -40.34 93.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.067 0.46 . . . . 73.150000000000006 109.783 176.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -49.81 75.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.35 -0.841 . . . . 74.239999999999995 110.067 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.43 HD22 ' HB3' ' A' ' 33' ' ' ASN . 10.4 m-80 -57.04 -44.23 82.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.097 -0.501 . . . . 52.119999999999997 110.835 177.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.617 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 56.3 t80 -61.36 -52.25 65.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.849 -0.614 . . . . 74.030000000000001 110.578 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.81 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 50.7 mm-40 -61.62 -37.54 84.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.763 0.316 . . . . 62.420000000000002 110.797 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -65.27 -42.34 93.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.272 -0.422 . . . . 64.239999999999995 110.105 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 tp -68.05 -37.31 81.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.913 -0.585 . . . . 71.439999999999998 110.82 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.81 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 59.2 mtpt -55.42 -49.87 71.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.486 0.66 . . . . 73.030000000000001 109.408 172.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 21.3 t -59.72 -40.84 89.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.34 -1.3 . . . . 74.530000000000001 110.739 176.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.27 -37.72 88.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 120.904 0.383 . . . . 73.540000000000006 110.728 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.608 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 21.3 t -71.76 -40.64 69.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.785 0.661 . . . . 71.530000000000001 112.785 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -65.29 -17.0 64.15 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 119.826 -0.75 . . . . 73.129999999999995 110.439 178.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.407 ' HG3' ' HD3' ' A' ' 21' ' ' ARG . 85.6 mttt -97.76 -64.48 1.04 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.957 -0.565 . . . . 71.5 111.654 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -110.62 -5.9 14.96 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 73.329999999999998 111.938 -172.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.608 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 4.3 mpt_? 63.67 12.8 6.85 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.893 0.477 . . . . 63.109999999999999 110.759 -177.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.523 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 39.6 ttt180 -170.38 168.78 7.82 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.744 -0.836 . . . . 73.150000000000006 108.744 -171.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.64 ' HE2' ' HB2' ' A' ' 38' ' ' CYS . 8.3 p90 -120.88 85.21 39.62 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-O 121.505 0.669 . . . . 73.549999999999997 109.89 174.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.39 -32.82 6.04 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.487 2.125 . . . . 54.020000000000003 111.817 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -129.04 105.45 8.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.713 -0.676 . . . . 74.349999999999994 109.532 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.1 m -73.58 99.19 2.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.165 -0.47 . . . . 70.319999999999993 110.6 -178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.42 -39.21 93.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.167 -0.469 . . . . 74.329999999999998 111.325 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -98.19 153.44 18.47 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.256 -0.429 . . . . 73.219999999999999 110.717 -178.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.61 -20.13 69.72 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.758 -0.937 . . . . 54.229999999999997 110.758 173.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.43 ' HB3' HD22 ' A' ' 12' ' ' ASN . 77.3 m-20 -63.8 -55.93 19.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.29 -0.455 . . . . 73.209999999999994 110.524 176.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.605 ' HA ' ' HB2' ' A' ' 37' ' ' TRP . 94.1 mt -71.95 -27.35 62.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.054 -0.521 . . . . 71.239999999999995 110.408 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.6 -43.72 98.9 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 110.604 -0.999 . . . . 74.349999999999994 110.604 173.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.23 -28.91 61.14 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.025 -0.607 . . . . 63.100000000000001 111.606 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.605 ' HB2' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.94 -50.52 70.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.371 0.605 . . . . 64.219999999999999 109.52 174.07 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.64 ' HB2' ' HE2' ' A' ' 26' ' ' PHE . 48.6 t -64.73 -40.48 95.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.177 -0.92 . . . . 73.239999999999995 111.049 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 44.7 m170 -72.02 -54.72 9.04 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.943 0.349 . . . . 74.230000000000004 111.943 -175.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.1 m -63.99 -40.43 96.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.079 0.466 . . . . 75.019999999999996 111.148 -174.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.725 ' HG2' HD22 ' A' ' 50' ' ' LEU . 9.9 mt-30 -84.13 -11.24 56.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.105 -0.498 . . . . 43.539999999999999 111.686 -177.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.597 ' HB2' ' O ' ' A' ' 38' ' ' CYS . 6.1 tpt180 -62.45 -36.25 81.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.932 0.873 . . . . 74.319999999999993 109.291 174.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 71.6 tttt -73.63 -54.36 8.33 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.405 -1.27 . . . . 75.25 111.134 178.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.45 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.4 mmt -57.62 -38.42 74.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.996 -0.547 . . . . 71.230000000000004 112.021 -178.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 9.5 ptm180 -65.24 -32.39 74.03 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.995 0.426 . . . . 75.329999999999998 110.899 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.16 -43.8 50.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.42 0.629 . . . . 64.25 109.561 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.489 ' NE2' ' HG3' ' A' ' 49' ' ' LYS . 27.8 mt-30 -72.58 -30.13 64.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.09 -0.959 . . . . 72.219999999999999 111.831 -177.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.87 30.41 17.88 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.523 -1.031 . . . . 74.340000000000003 110.523 -171.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.858 ' HE2' ' HA ' ' A' ' 49' ' ' LYS . 10.2 mmpt? -102.35 -8.44 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 115.3 -0.45 . . . . 74.340000000000003 110.257 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.725 HD22 ' HG2' ' A' ' 41' ' ' GLN . 2.9 mt -63.33 139.02 97.51 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.603 -0.726 . . . . 74.510000000000005 109.51 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.688 ' HD2' HD23 ' A' ' 50' ' ' LEU . 56.5 Cg_endo -75.71 145.19 28.82 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.105 1.87 . . . . 73.540000000000006 112.337 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.1 -30.4 70.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.347 -0.842 . . . . 52.539999999999999 110.264 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.683 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.7 m-20 -59.73 -51.01 71.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.914 -0.584 . . . . 75.030000000000001 110.828 176.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.455 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 2.3 tmt_? -57.31 -38.23 73.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.096 0.474 . . . . 64.310000000000002 110.018 -179.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttt180 -64.6 -49.58 70.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.797 -0.638 . . . . 71.439999999999998 110.475 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 56' ' ' LEU . 4.3 tt -64.87 -40.02 94.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.352 -0.84 . . . . 74.409999999999997 110.13 -176.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.683 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.4 mt -55.12 -39.94 69.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 73.310000000000002 111.042 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 87.3 mt -61.85 -45.48 93.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.036 -0.529 . . . . 73.340000000000003 110.665 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -65.36 -33.42 75.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.972 0.415 . . . . 65.0 110.879 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.71 -36.14 75.65 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.929 -0.578 . . . . 74.340000000000003 111.16 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.682 HG22 ' HG2' ' A' ' 17' ' ' LYS . 19.5 pt -85.68 -26.57 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.594 -0.275 . . . . 62.439999999999998 111.524 176.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 109.97 33.85 2.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.548 -0.834 . . . . 60.5 112.797 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.602 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 77.8 t80 -72.31 135.21 45.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.877 0.37 . . . . 75.120000000000005 110.328 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 p -92.99 126.62 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-O 121.55 0.69 . . . . 71.120000000000005 110.554 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 76.3 m95 -92.18 32.02 1.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.583 -0.735 . . . . 73.349999999999994 109.967 -178.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 m 74.61 -47.42 0.63 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.516 -0.766 . . . . 74.129999999999995 110.665 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.445 HD22 ' H ' ' A' ' 67' ' ' LEU . 2.4 pt? -127.9 158.59 37.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.868 0.366 . . . . 75.239999999999995 110.112 175.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -107.45 -84.67 0.52 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.365 -0.606 . . . . 52.399999999999999 109.365 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -156.92 -171.79 3.79 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.417 -0.957 . . . . 64.239999999999995 108.417 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -98.35 58.97 1.31 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.72 -1.215 . . . . 74.349999999999994 107.72 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 -90.64 -57.75 2.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.769 -1.105 . . . . 62.43 111.589 -168.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.587 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 50.8 t-80 -133.4 72.34 1.48 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.853 -0.339 . . . . 62.43 111.677 -174.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.587 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 28.8 t60 168.79 -85.01 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.413 -0.812 . . . . 72.439999999999998 109.798 170.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.401 ' H ' ' HB3' ' A' ' 73' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.244 0.805 0 CA-C-O 118.881 -0.58 . . . . 75.25 109.484 -178.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.6 ttm . . . . . 0 N--CA 1.479 1.018 0 N-CA-C 110.278 -0.268 . . . . 75.349999999999994 110.278 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 68.2 -75.83 0.06 Allowed 'General case' 0 CA--C 1.532 0.257 0 O-C-N 123.801 0.688 . . . . 74.5 112.06 176.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.747 ' HG2' ' HG3' ' A' ' 11' ' ' LYS . 36.5 mt-30 57.41 36.77 27.48 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 122.733 0.413 . . . . 70.209999999999994 111.378 -176.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 40.6 t-20 -61.85 146.73 48.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.939 -0.393 . . . . 74.209999999999994 109.939 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.506 ' H ' HD11 ' A' ' 5' ' ' LEU . 5.8 mp -52.4 -41.01 62.79 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.334 0.588 . . . . 64.299999999999997 110.031 176.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -95.18 15.15 19.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.476 -0.784 . . . . 74.010000000000005 111.01 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -141.41 28.95 2.3 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.733 -0.746 . . . . 45.530000000000001 112.136 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -84.0 -14.67 50.14 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.95 -0.3 . . . . 73.120000000000005 110.466 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.473 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -58.27 -56.58 20.21 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.023 -0.732 . . . . 65.219999999999999 109.023 178.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 47.9 ttm -55.32 -33.81 63.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 54.009999999999998 110.871 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.747 ' HG3' ' HG2' ' A' ' 3' ' ' GLN . 0.4 OUTLIER -68.36 -53.98 20.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.56 -0.745 . . . . 72.109999999999999 110.471 -177.573 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.465 ' ND2' ' HA ' ' A' ' 9' ' ' TRP . 8.3 p30 -77.11 -20.06 56.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.75 0.309 . . . . 75.239999999999995 111.077 -176.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -51.38 -43.78 61.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 74.219999999999999 110.137 173.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -62.91 -36.4 83.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.891 -0.595 . . . . 74.319999999999993 111.304 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.3 -44.1 92.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 73.030000000000001 111.237 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.445 ' O ' HD21 ' A' ' 16' ' ' LEU . 3.4 tt -79.14 -32.58 44.43 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.591 -0.892 . . . . 72.140000000000001 108.591 -176.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -51.38 -51.91 50.49 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.729 -1.123 . . . . 73.299999999999997 110.511 174.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 25.6 t -76.58 -34.62 58.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.495 -0.775 . . . . 74.540000000000006 110.685 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 3.1 t80 -66.0 -45.35 81.89 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.869 0.366 . . . . 73.319999999999993 110.861 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.549 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 7.7 p -65.75 -34.4 70.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.373 -0.376 . . . . 73.329999999999998 111.588 -176.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HD2' ' C ' ' A' ' 21' ' ' ARG . 5.6 ppt_? -79.43 -16.39 56.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.352 0.596 . . . . 74.340000000000003 110.325 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.8 tptm -89.31 -53.72 4.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.694 -0.685 . . . . 75.219999999999999 111.137 -174.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -115.57 -10.36 11.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.8 -0.182 . . . . 75.219999999999999 111.364 -178.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.549 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 64.16 93.45 0.06 Allowed 'General case' 0 CA--C 1.518 -0.286 0 O-C-N 123.667 0.604 . . . . 75.340000000000003 110.126 -170.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.652 ' HD3' ' O ' ' A' ' 64' ' ' VAL . 57.0 mtm180 65.92 -174.69 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 114.569 -1.196 . . . . 74.299999999999997 110.551 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.765 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 2.9 p90 -127.49 81.39 70.22 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.785 -0.643 . . . . 74.239999999999995 109.819 171.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -66.46 107.12 1.16 Allowed 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 123.099 2.533 . . . . 50.450000000000003 112.169 -176.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 59.99 25.53 14.74 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.877 -0.601 . . . . 72.439999999999998 111.17 177.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.765 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 45.2 m -88.9 133.73 34.2 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.814 -0.63 . . . . 73.129999999999995 109.422 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.419 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 9.2 p -72.26 -42.67 65.35 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.514 -0.312 . . . . 73.140000000000001 110.947 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 32' ' ' GLY . 1.7 tm-20 56.3 -158.38 0.24 Allowed 'General case' 0 CA--C 1.532 0.255 0 O-C-N 123.691 0.62 . . . . 72.099999999999994 110.003 177.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.451 ' H ' ' CD ' ' A' ' 31' ' ' GLU . . . -130.38 -87.49 0.46 Allowed Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 111.248 -0.741 . . . . 70.239999999999995 111.248 176.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.449 ' O ' ' HB2' ' A' ' 37' ' ' TRP . 6.9 p30 -70.21 -38.68 75.32 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.461 0.171 . . . . 64.519999999999996 111.461 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.43 -28.31 59.31 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.869 0.366 . . . . 53.32 110.807 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.419 ' HA3' ' O ' ' A' ' 30' ' ' THR . . . -61.16 -45.59 96.24 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.689 -0.767 . . . . 74.239999999999995 111.53 178.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.03 -29.31 59.03 Favored Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 111.143 -0.783 . . . . 65.310000000000002 111.143 176.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.449 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 2.7 t90 -58.16 -55.79 30.42 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.085 0.554 . . . . 73.219999999999999 110.508 178.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.32 -46.76 87.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 73.040000000000006 110.787 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.432 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.3 m80 -57.43 -46.21 83.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.122 -0.49 . . . . 75.5 112.013 -178.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.504 ' O ' ' HE1' ' A' ' 44' ' ' MET . 1.3 t -70.65 -35.08 72.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.018 0.437 . . . . 63.340000000000003 110.848 -175.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.547 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 3.0 mt-30 -86.42 -21.39 27.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.23 0.826 . . . . 70.219999999999999 113.23 -172.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -69.17 -22.75 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.095 -0.642 . . . . 75.120000000000005 109.494 174.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.424 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 2.8 tmmm? -73.45 -30.41 63.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.359 -0.837 . . . . 70.349999999999994 109.952 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.547 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 13.4 mmt -67.62 -33.83 75.77 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.744 0.307 . . . . 74.299999999999997 110.39 174.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.744 ' HB2' HD11 ' A' ' 50' ' ' LEU . 17.4 tpt180 -72.98 -39.06 66.41 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.519 -0.472 . . . . 75.099999999999994 110.389 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -56.93 -44.76 82.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.372 0.606 . . . . 72.209999999999994 109.602 173.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.462 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 47.7 mt-30 -64.83 -29.58 70.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.191 -0.913 . . . . 71.400000000000006 110.996 174.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.99 28.65 44.86 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.969 -0.634 . . . . 75.129999999999995 111.582 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.462 ' HG2' ' HB2' ' A' ' 47' ' ' GLN . 18.3 ptmt -113.16 0.42 14.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 73.239999999999995 111.025 -176.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.744 HD11 ' HB2' ' A' ' 45' ' ' ARG . 1.8 mt -58.81 139.94 86.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.81 -0.632 . . . . 75.409999999999997 110.207 179.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -82.23 158.63 17.56 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 122.672 2.248 . . . . 73.530000000000001 111.486 173.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -71.08 -31.8 68.28 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.07 -0.968 . . . . 73.510000000000005 110.643 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.6 -51.24 50.32 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.917 -0.583 . . . . 74.140000000000001 112.231 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.571 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 47.5 ttt-85 -60.92 -50.52 73.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.047 0.451 . . . . 74.150000000000006 110.451 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.408 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -64.89 -26.83 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.764 -0.653 . . . . 74.519999999999996 110.964 -178.57 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -77.11 -51.73 10.52 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.212 -0.449 . . . . 74.530000000000001 110.726 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.2 mp -58.99 -43.23 91.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.447 -0.342 . . . . 53.350000000000001 111.043 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.612 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 71.2 mt -62.24 -40.77 97.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 75.340000000000003 110.31 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.408 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 15.6 t70 -57.68 -41.18 81.09 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.861 -0.609 . . . . 75.129999999999995 111.105 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.433 ' N ' ' HD2' ' A' ' 60' ' ' LYS . 1.6 mptp? -77.31 -28.93 53.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.756 -0.656 . . . . 74.319999999999993 112.589 -173.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 16.1 pt -82.85 -14.34 11.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.269 -0.572 . . . . 71.140000000000001 110.89 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 112.16 23.52 5.48 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.37 -0.919 . . . . 37.5 113.532 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.612 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 32.6 t80 -88.58 103.8 16.24 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.344 0.592 . . . . 71.209999999999994 109.794 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.652 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 14.4 p -99.02 129.17 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-N 115.205 -0.907 . . . . 72.030000000000001 110.775 -177.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -68.57 -29.42 67.96 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.332 -0.395 . . . . 72.120000000000005 111.236 -175.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 42.2 m 64.68 -177.71 0.17 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.78 -0.646 . . . . 71.420000000000002 111.865 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.472 ' H ' HD21 ' A' ' 67' ' ' LEU . 2.6 pt? -86.22 14.93 5.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.143 -0.481 . . . . 70.540000000000006 111.533 -176.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -80.16 2.6 23.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.193 0.521 . . . . 60.130000000000003 110.993 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -136.81 -51.16 0.67 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.375 -0.602 . . . . 72.010000000000005 109.375 173.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -95.86 105.64 17.67 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.11 -0.7 . . . . 73.420000000000002 109.11 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -81.91 169.13 17.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.929 -0.578 . . . . 75.219999999999999 110.693 -175.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -91.39 137.34 32.44 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.335 -0.617 . . . . 74.510000000000005 109.335 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.13 -35.6 71.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.894 0.378 . . . . 73.319999999999993 111.037 -176.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.16 -0.924 . . . . 73.430000000000007 109.469 173.45 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 120.751 0.31 . . . . 61.240000000000002 110.393 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -79.59 79.07 6.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.547 0.689 . . . . 71.129999999999995 111.381 -178.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -165.59 82.86 0.33 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.679 -1.146 . . . . 71.219999999999999 107.954 173.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -127.67 -1.97 6.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.43 -0.805 . . . . 74.230000000000004 111.671 -171.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.3 mt -75.28 -41.23 57.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.486 -0.325 . . . . 70.519999999999996 110.593 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 67.58 146.3 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.901 0.75 . . . . 62.039999999999999 112.26 -178.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 70.53 35.78 68.15 Favored Glycine 0 N--CA 1.444 -0.782 0 CA-C-N 115.511 -0.768 . . . . 74.109999999999999 113.029 174.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 8.4 tm-20 -63.59 -27.54 69.31 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 109.048 -0.723 . . . . 65.340000000000003 109.048 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.462 ' HZ2' HD11 ' A' ' 57' ' ' LEU . 6.2 t-105 -61.58 -48.63 80.1 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.908 0.385 . . . . 72.329999999999998 110.36 173.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 78.1 mmm -61.6 -29.88 70.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 74.049999999999997 110.42 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HB3' ' HE3' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -78.26 -49.6 13.41 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.522 -0.763 . . . . 72.0 109.788 176.587 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 8' ' ' GLU . 2.0 t-20 -52.74 -35.67 56.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.194 0.998 . . . . 74.200000000000003 111.164 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -52.87 -39.41 62.6 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.979 -1.009 . . . . 73.510000000000005 110.833 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -63.44 -43.24 97.97 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.139 0.274 . . . . 75.099999999999994 111.521 -177.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.52 -40.45 97.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.002 0.43 . . . . 73.519999999999996 110.771 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.9 tp -78.65 -45.36 21.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.439 0.638 . . . . 74.400000000000006 109.321 -173.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -51.05 -51.02 57.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.442 -1.254 . . . . 63.520000000000003 111.353 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.0 m -70.41 -38.28 74.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.251 -0.886 . . . . 71.129999999999995 111.029 -176.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -76.36 -44.98 34.05 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.446 -0.502 . . . . 72.109999999999999 111.092 -173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.669 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 54.5 t -61.4 -33.91 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 110.993 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -58.26 -29.26 65.65 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.112 0.482 . . . . 62.439999999999998 110.767 176.013 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -91.26 -61.58 1.63 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.225 -0.443 . . . . 62.43 111.703 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -101.59 -6.7 23.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.35 0.5 . . . . 71.299999999999997 112.35 -174.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.669 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 28.4 mmt180 68.43 -0.59 2.17 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.173 0.589 . . . . 71.109999999999999 111.684 -178.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 80.9 mtt180 -168.71 172.01 8.25 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.326 1.05 . . . . 74.349999999999994 108.722 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.584 ' HB2' ' O ' ' A' ' 29' ' ' SER . 10.2 p90 -126.93 86.07 59.63 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 121.345 0.593 . . . . 74.25 110.332 172.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.02 -49.5 0.38 Allowed 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.855 2.37 . . . . 73.310000000000002 112.341 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -102.95 -39.07 7.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.419 -0.355 . . . . 74.409999999999997 110.703 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.584 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 52.8 m -77.81 89.47 4.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.44 . . . . 74.340000000000003 111.452 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 34' ' ' LEU . 4.9 p -83.44 -55.24 4.42 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.973 -0.558 . . . . 65.019999999999996 111.177 179.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 66.01 159.99 0.13 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.038 -0.528 . . . . 74.040000000000006 110.291 -176.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.84 -51.16 57.74 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.443 -0.884 . . . . 37.57 112.519 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.426 ' HB3' HD22 ' A' ' 12' ' ' ASN . 15.0 m120 -66.1 -55.27 17.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.562 -0.319 . . . . 72.450000000000003 111.792 -176.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 30' ' ' THR . 83.0 mt -71.9 -38.76 69.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.415 -0.357 . . . . 74.230000000000004 111.756 -173.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.95 -43.74 96.6 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.923 -0.656 . . . . 51.009999999999998 111.889 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.19 -34.77 54.49 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.382 -0.687 . . . . 70.400000000000006 111.382 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.52 ' HH2' HD21 ' A' ' 58' ' ' LEU . 9.0 t90 -54.34 -52.22 62.26 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.31 0.576 . . . . 72.430000000000007 109.831 174.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.478 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.1 t -62.49 -46.33 88.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.937 -1.029 . . . . 72.129999999999995 111.131 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -56.77 -45.56 82.04 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.832 0.308 . . . . 73.230000000000004 111.832 -177.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 91.6 m -65.07 -48.17 74.73 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.314 -0.403 . . . . 71.030000000000001 111.691 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -84.7 -24.41 28.95 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.217 0.821 . . . . 71.439999999999998 113.217 -170.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.408 ' HD2' ' C ' ' A' ' 42' ' ' ARG . 1.4 tmm_? -62.88 -33.34 75.09 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.731 -0.84 . . . . 73.040000000000006 108.731 173.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.45 ' HB3' ' O ' ' A' ' 40' ' ' THR . 62.3 tttt -61.88 -50.52 71.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.248 -0.887 . . . . 74.530000000000001 110.575 175.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.625 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.6 mmt -61.39 -34.0 74.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 75.319999999999993 110.848 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.02 -48.11 81.75 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.458 -0.571 . . . . 61.310000000000002 109.458 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.9 tttp -66.65 -49.32 66.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.287 -0.869 . . . . 74.129999999999995 111.054 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.429 ' NE2' ' HD3' ' A' ' 49' ' ' LYS . 26.5 mt-30 -60.79 -32.08 71.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.943 -0.571 . . . . 73.349999999999994 111.757 178.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.32 41.01 5.91 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.581 -0.819 . . . . 60.350000000000001 111.95 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.429 ' HD3' ' NE2' ' A' ' 47' ' ' GLN . 16.2 ptmt -133.31 11.47 4.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.014 0.435 . . . . 75.010000000000005 111.459 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.625 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 4.1 mt -64.79 141.24 98.28 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-N 115.88 -0.6 . . . . 74.400000000000006 109.808 175.379 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.69 134.84 31.42 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.72 2.28 . . . . 74.140000000000001 111.755 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -60.19 -39.48 86.7 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.378 -0.828 . . . . 72.319999999999993 109.942 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.626 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.8 m-20 -56.61 -43.72 80.45 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.729 -0.669 . . . . 65.430000000000007 110.44 176.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -62.5 -49.47 75.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.563 -0.744 . . . . 42.340000000000003 110.265 -178.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -51.73 -44.37 63.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.403 -0.817 . . . . 74.329999999999998 110.309 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.594 ' HA ' ' OD2' ' A' ' 59' ' ' ASP . 7.0 mp -64.7 -41.71 95.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 72.109999999999999 111.481 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.1 mt -53.19 -39.38 63.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.937 0.399 . . . . 65.540000000000006 110.648 178.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.579 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 4.3 mm? -68.48 -49.51 59.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.68 -0.691 . . . . 75.510000000000005 111.411 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.594 ' OD2' ' HA ' ' A' ' 56' ' ' LEU . 1.9 p30 -73.27 -20.56 60.8 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.154 -0.619 . . . . 73.109999999999999 111.03 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -65.86 -41.4 91.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.784 0.326 . . . . 74.450000000000003 111.407 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -84.61 -2.74 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 74.230000000000004 110.871 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.511 ' O ' ' HD2' ' A' ' 24' ' ' ARG . . . 97.23 22.89 15.79 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 120.76 -0.734 . . . . 37.57 113.609 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.579 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 72.1 t80 -75.05 133.31 41.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.473 0.654 . . . . 73.340000000000003 110.164 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.701 HG11 ' H ' ' A' ' 66' ' ' SER . 73.6 t -91.62 127.84 43.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.058 -0.974 . . . . 72.420000000000002 110.715 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.405 ' O ' ' HB2' ' A' ' 66' ' ' SER . 94.6 m95 -101.16 20.51 15.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.621 . . . . 73.230000000000004 109.842 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.701 ' H ' HG11 ' A' ' 64' ' ' VAL . 70.0 m 72.24 168.76 0.31 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.362 -0.836 . . . . 74.230000000000004 110.644 -173.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.24 58.68 2.12 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.456 0.646 . . . . 75.530000000000001 111.804 -177.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -76.18 87.2 3.03 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.645 -0.707 . . . . 74.239999999999995 110.882 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -135.6 136.92 41.44 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.072 -0.967 . . . . 72.340000000000003 108.883 175.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 29.5 m170 -74.75 126.22 30.42 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.201 0.524 . . . . 73.019999999999996 111.543 -175.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 9.9 p-80 -65.04 150.56 47.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.105 -0.952 . . . . 75.319999999999993 110.761 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -108.41 144.55 35.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.593 -0.521 . . . . 71.430000000000007 109.593 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -67.39 -53.09 32.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.989 -0.374 . . . . 65.319999999999993 109.989 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 52.5 t-80 . . . . . 0 C--O 1.251 1.174 0 CA-C-O 118.535 -0.745 . . . . 74.120000000000005 109.611 178.145 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.6 mtp . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.865 0.364 . . . . 74.519999999999996 110.634 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -130.09 -170.65 2.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.433 -0.349 . . . . 75.450000000000003 110.409 -178.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -80.81 84.28 6.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.996 0.903 . . . . 75.420000000000002 110.605 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 5' ' ' LEU . 26.3 p-10 -101.47 16.03 26.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.988 -1.006 . . . . 74.140000000000001 110.286 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 4' ' ' ASN . 94.3 mt 74.83 98.47 0.07 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.715 -1.13 . . . . 73.230000000000004 109.632 -175.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -104.01 170.21 8.05 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.392 -0.822 . . . . 75.319999999999993 110.174 -173.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.22 92.77 0.32 Allowed Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.189 -1.164 . . . . 54.299999999999997 110.189 169.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -60.08 -37.57 80.32 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.258 0.075 . . . . 71.349999999999994 111.188 -172.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.737 ' HH2' HH21 ' A' ' 54' ' ' ARG . 5.8 t-105 -59.33 -52.67 64.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.847 0.356 . . . . 72.329999999999998 110.429 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.819 ' HA ' ' HE3' ' A' ' 10' ' ' MET . 2.1 tpt -56.88 -37.57 71.54 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.229 0.538 . . . . 61.32 110.29 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.46 ' C ' ' HD2' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.63 -46.91 51.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.64 -0.709 . . . . 74.409999999999997 110.594 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -56.82 -35.48 68.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.961 0.41 . . . . 65.239999999999995 110.767 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.402 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 40.8 t80 -59.94 -50.71 72.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.002 -0.544 . . . . 75.25 109.896 176.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 6.4 mm-40 -63.87 -39.04 93.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.083 -0.508 . . . . 73.329999999999998 110.717 176.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -61.82 -37.05 82.96 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.611 . . . . 74.140000000000001 110.282 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.764 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.0 tt -76.65 -43.21 39.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 65.349999999999994 111.016 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 58.2 mtpt -55.99 -57.02 13.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.329 0.585 . . . . 72.430000000000007 110.552 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 36.9 p -57.99 -30.2 65.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.853 -1.067 . . . . 74.25 111.322 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.536 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 34.8 t80 -70.62 -49.63 45.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.346 . . . . 72.510000000000005 110.305 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.2 t -59.63 -37.93 73.11 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 N-CA-C 111.777 0.288 . . . . 75.349999999999994 111.777 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -74.71 -18.88 60.44 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.374 -0.53 . . . . 65.430000000000007 110.586 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 18' ' ' SER . 53.5 tttm -94.87 -46.38 6.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 64.25 111.335 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.402 ' CE2' ' HD3' ' A' ' 22' ' ' LYS . 64.7 m-85 -118.31 -19.69 8.83 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.148 -0.221 . . . . 73.25 111.33 -176.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.611 ' NH1' ' HA3' ' A' ' 62' ' ' GLY . 11.3 mmm180 65.85 98.5 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 O-C-N 123.778 0.674 . . . . 73.040000000000006 111.563 -178.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 71.29 163.4 0.26 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.936 -1.029 . . . . 75.25 110.962 179.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.563 ' HE2' ' HB3' ' A' ' 38' ' ' CYS . 8.4 p90 -140.79 83.37 14.5 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-O 121.518 0.675 . . . . 74.400000000000006 110.81 175.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -83.33 96.47 0.8 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.909 2.406 . . . . 73.109999999999999 111.22 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.732 ' HZ3' ' HB2' ' A' ' 28' ' ' LYS . 8.0 mtmp? 69.63 18.73 7.56 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.008 -0.542 . . . . 73.420000000000002 111.084 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.465 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 19.1 m -68.85 -40.31 79.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.553 -0.294 . . . . 61.140000000000001 111.044 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.467 ' HA ' ' HA2' ' A' ' 35' ' ' GLY . 0.2 OUTLIER 55.83 30.96 16.74 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.905 -0.589 . . . . 74.049999999999997 112.387 176.87 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -93.29 145.17 24.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.267 -0.424 . . . . 71.219999999999999 111.657 -178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.21 -159.33 33.21 Favored Glycine 0 N--CA 1.451 -0.339 0 CA-C-N 115.659 -0.7 . . . . 53.509999999999998 112.321 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -70.74 -20.33 62.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.296 0.57 . . . . 72.230000000000004 109.717 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.764 HD11 ' HA ' ' A' ' 16' ' ' LEU . 57.2 mt -64.13 -33.68 76.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.213 -0.903 . . . . 72.430000000000007 111.155 -178.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.467 ' HA2' ' HA ' ' A' ' 30' ' ' THR . . . -51.65 -43.22 53.29 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.934 -0.651 . . . . 72.329999999999998 111.985 172.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.04 -31.45 34.94 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.849 -0.691 . . . . 75.319999999999993 111.697 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -56.87 -50.54 72.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.901 0.382 . . . . 71.129999999999995 110.719 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.563 ' HB3' ' HE2' ' A' ' 26' ' ' PHE . 30.0 p -65.05 -30.34 71.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 72.519999999999996 111.118 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -63.61 -47.25 82.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.788 0.328 . . . . 73.439999999999998 111.08 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.55 HG23 ' HE1' ' A' ' 44' ' ' MET . 23.5 m -77.62 -20.86 53.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.205 0.526 . . . . 52.32 110.945 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.483 ' HG3' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -77.64 -25.82 50.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.553 -0.294 . . . . 70.239999999999995 110.972 179.667 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 12.3 mmt180 -54.1 -47.1 72.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.226 0.536 . . . . 71.209999999999994 109.599 172.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 40' ' ' THR . 28.1 tttp -51.54 -62.56 1.55 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.624 -1.171 . . . . 73.239999999999995 111.181 175.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.55 ' HE1' HG23 ' A' ' 40' ' ' THR . 11.8 mmt -55.81 -46.22 78.11 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.058 -0.519 . . . . 73.209999999999994 112.229 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.599 ' NH2' ' HG3' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -65.13 -39.33 92.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.342 0.497 . . . . 74.120000000000005 112.342 -170.681 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.456 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 62.9 pttt -80.21 -19.19 47.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 75.310000000000002 110.4 -179.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -89.77 -14.86 33.64 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.445 -0.798 . . . . 75.329999999999998 110.876 178.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.92 27.49 68.71 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.833 -0.622 . . . . 52.409999999999997 112.297 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -100.53 -12.8 18.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.76 0.314 . . . . 73.409999999999997 110.748 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 1.035 HD22 ' HD2' ' A' ' 51' ' ' PRO . 0.5 OUTLIER -60.03 139.12 91.0 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.86 -0.609 . . . . 70.230000000000004 109.661 177.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 1.035 ' HD2' HD22 ' A' ' 50' ' ' LEU . 39.9 Cg_endo -73.28 127.92 12.39 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.303 2.002 . . . . 74.310000000000002 112.671 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.403 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 32.4 t-20 -59.39 -37.39 77.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.001 -0.999 . . . . 71.439999999999998 109.876 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -56.1 -48.58 75.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.569 -0.741 . . . . 64.209999999999994 111.306 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.737 HH21 ' HH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -71.14 -26.24 62.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.266 -0.424 . . . . 75.230000000000004 110.118 -175.187 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.403 ' HB3' ' O ' ' A' ' 52' ' ' ASN . 25.4 ttm-85 -61.84 -39.97 93.67 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.155 0.502 . . . . 73.420000000000002 109.792 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 mp -70.2 -32.14 69.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.595 -0.729 . . . . 63.030000000000001 110.76 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.72 -39.4 94.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.151 0.501 . . . . 75.439999999999998 109.8 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 82.3 mt -71.04 -33.43 70.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.842 -0.617 . . . . 54.32 110.17 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.49 -32.65 74.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 74.430000000000007 110.887 177.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -62.0 -40.44 95.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 73.450000000000003 111.608 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 11.2 pt -87.99 -12.38 10.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.855 0.359 . . . . 73.319999999999993 111.362 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.611 ' HA3' ' NH1' ' A' ' 24' ' ' ARG . . . 102.79 25.86 7.41 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.69 -0.767 . . . . 74.540000000000006 113.623 174.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.732 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 56.2 t80 -76.33 104.96 7.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.484 -0.561 . . . . 74.200000000000003 109.484 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 6.6 p -80.43 151.93 4.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 74.420000000000002 111.133 -175.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -116.24 28.72 8.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.492 -0.322 . . . . 75.420000000000002 111.622 -175.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.1 m -62.79 -21.01 65.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.211 0.449 . . . . 63.200000000000003 112.211 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.427 HD11 ' N ' ' A' ' 67' ' ' LEU . 5.5 mp -91.96 7.61 41.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.78 0.324 . . . . 64.319999999999993 111.26 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.599 ' HG3' ' NH2' ' A' ' 45' ' ' ARG . 21.2 tt0 -74.16 128.42 35.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.049 0.452 . . . . 64.230000000000004 111.246 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -72.11 143.56 48.97 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.336 -0.616 . . . . 70.219999999999999 109.336 177.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -67.4 -14.35 62.84 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.263 0.838 . . . . 73.430000000000007 113.263 -169.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 64.13 23.74 13.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.381 0.61 . . . . 74.239999999999995 110.897 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -104.76 160.37 15.04 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.202 -0.454 . . . . 70.140000000000001 110.308 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -89.49 124.72 34.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.345 -0.389 . . . . 64.310000000000002 110.739 -176.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 42.3 t-80 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.477 -0.773 . . . . 63.109999999999999 109.603 176.436 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 mpp? . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 120.501 0.191 . . . . 64.129999999999995 110.581 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -101.04 86.35 3.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.968 0.889 . . . . 74.209999999999994 109.107 171.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -94.57 -52.73 4.18 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.942 -1.027 . . . . 63.43 110.75 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -91.88 115.83 28.39 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.808 -0.633 . . . . 72.209999999999994 110.383 -178.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 82.5 mt -97.59 145.84 25.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.753 -0.658 . . . . 72.209999999999994 110.378 -178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.597 HE22 ' HB2' ' A' ' 8' ' ' GLU . 0.3 OUTLIER -140.42 124.71 17.71 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.36 -0.607 . . . . 74.340000000000003 109.36 179.285 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.9 64.24 3.7 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.229 -0.51 . . . . 41.25 112.607 -174.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.597 ' HB2' HE22 ' A' ' 6' ' ' GLN . 20.9 tt0 -77.13 -26.31 53.04 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 110.17 -0.307 . . . . 63.420000000000002 110.17 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -45.55 84.92 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.823 -0.806 . . . . 73.420000000000002 108.823 175.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.5 ttm -58.09 -40.87 82.19 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.219 -0.446 . . . . 64.549999999999997 110.017 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -58.05 -55.84 29.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.391 -0.822 . . . . 73.450000000000003 110.098 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.99 -39.42 81.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.449 -0.796 . . . . 62.310000000000002 111.171 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -59.4 -47.96 83.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 75.310000000000002 110.824 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.31 -40.91 96.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.849 0.357 . . . . 61.219999999999999 111.119 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.662 ' HB3' HD22 ' A' ' 34' ' ' LEU . 16.5 mm-40 -62.67 -32.57 73.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.22 -0.446 . . . . 73.150000000000006 110.969 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.837 HD11 HD13 ' A' ' 58' ' ' LEU . 1.2 tt -84.79 -34.45 22.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.822 -0.807 . . . . 71.319999999999993 108.822 -178.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -55.38 -37.12 67.14 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.051 -0.977 . . . . 70.430000000000007 109.491 172.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -82.55 -27.65 31.49 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 73.129999999999995 110.951 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -75.27 -36.17 61.26 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.837 0.351 . . . . 75.5 110.843 -177.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.468 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 62.9 t -57.96 -38.02 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 73.329999999999998 110.276 173.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.5 tmt_? -76.03 -24.86 55.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.233 0.539 . . . . 74.209999999999994 109.944 176.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.419 ' HG3' ' CD2' ' A' ' 23' ' ' TYR . 24.5 tptm -71.66 -60.54 2.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.656 . . . . 75.5 111.482 -176.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.419 ' CD2' ' HG3' ' A' ' 22' ' ' LYS . 58.2 m-85 -126.15 3.96 7.15 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 63.219999999999999 112.196 -177.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.468 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 26.7 mmt-85 61.39 93.95 0.04 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.855 0.36 . . . . 74.209999999999994 110.802 -173.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.934 ' HG2' ' H ' ' A' ' 26' ' ' PHE . 40.2 ttt180 58.73 -169.57 0.13 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.618 -0.719 . . . . 74.349999999999994 109.927 -174.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.934 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 0.7 OUTLIER -141.25 140.02 20.15 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-O 120.746 0.307 . . . . 73.349999999999994 110.253 170.731 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.436 ' HD2' ' H ' ' A' ' 28' ' ' LYS . 4.8 Cg_endo -90.48 -26.47 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.246 2.631 . . . . 62.530000000000001 110.989 170.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.436 ' H ' ' HD2' ' A' ' 27' ' ' PRO . 85.2 tttt -175.07 81.26 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.799 -1.091 . . . . 65.349999999999994 108.41 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.5 p -78.2 142.77 37.7 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.85 -0.614 . . . . 51.539999999999999 111.591 -173.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.9 p -122.17 5.02 9.78 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.852 -0.613 . . . . 71.400000000000006 110.473 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -93.61 109.99 21.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.751 -0.659 . . . . 65.109999999999999 111.325 -172.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 54.49 -138.89 39.8 Favored Glycine 0 CA--C 1.517 0.198 0 CA-C-N 115.265 -0.88 . . . . 75.340000000000003 114.167 173.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -64.04 -35.35 80.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.438 -0.381 . . . . 74.140000000000001 111.233 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.662 HD22 ' HB3' ' A' ' 15' ' ' GLU . 2.7 mm? -64.25 -28.55 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 74.450000000000003 111.062 -176.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -55.87 -44.77 87.36 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 74.420000000000002 112.062 174.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -83.08 -28.0 38.76 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.682 -0.771 . . . . 65.5 112.177 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.429 ' CH2' ' HG2' ' A' ' 41' ' ' GLN . 16.5 t90 -57.87 -50.55 72.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.707 -0.246 . . . . 73.219999999999999 111.02 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.41 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 26.8 p -59.85 -40.97 90.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.228 -0.442 . . . . 61.409999999999997 110.756 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -59.02 -46.1 89.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 73.530000000000001 110.73 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -76.16 -40.17 53.23 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.771 -0.65 . . . . 73.209999999999994 111.259 -175.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.429 ' HG2' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -78.7 -22.56 46.5 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.882 0.327 . . . . 54.020000000000003 111.882 -175.156 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.43 ' HD3' ' C ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -65.64 -33.22 75.39 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.702 -0.481 . . . . 73.0 109.702 176.379 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -58.42 -52.49 65.4 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.04 -0.527 . . . . 72.430000000000007 109.971 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.706 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 9.6 mmt -58.56 -33.35 69.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.335 -0.848 . . . . 74.040000000000006 110.657 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.95 -39.94 75.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.689 -0.687 . . . . 71.340000000000003 110.197 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -72.24 -48.5 42.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.876 -0.602 . . . . 55.119999999999997 110.698 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -63.56 -22.22 66.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.658 -0.701 . . . . 73.230000000000004 111.747 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 76.25 29.92 57.75 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.682 -0.771 . . . . 64.239999999999995 111.479 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -113.75 3.15 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.8 0.333 . . . . 74.200000000000003 110.45 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.706 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 2.6 mt -59.65 138.26 89.78 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.689 -0.687 . . . . 72.510000000000005 109.376 175.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.467 ' HD2' HD22 ' A' ' 50' ' ' LEU . 81.5 Cg_endo -84.62 149.45 11.35 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.218 1.945 . . . . 64.439999999999998 112.333 176.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -70.98 -27.44 63.71 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.15 -0.932 . . . . 75.430000000000007 109.976 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.55 -51.7 68.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 40.299999999999997 110.433 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.464 ' O ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -63.87 -38.54 91.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 73.319999999999993 110.309 179.513 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -61.67 -45.94 91.87 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.038 -0.528 . . . . 61.100000000000001 110.563 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.3 tp -68.71 -42.27 77.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.387 -0.37 . . . . 71.319999999999993 111.55 -177.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.36 -39.46 79.61 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.737 0.303 . . . . 73.25 110.86 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.837 HD13 HD11 ' A' ' 16' ' ' LEU . 4.3 mm? -71.14 -43.31 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.24 0.543 . . . . 74.450000000000003 110.765 177.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.92 -28.55 69.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 71.239999999999995 110.231 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -74.61 -30.13 61.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 70.219999999999999 112.373 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.743 HD12 HD11 ' A' ' 58' ' ' LEU . 27.2 pt -87.72 1.47 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 120.519 -0.472 . . . . 74.040000000000006 111.101 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.88 16.31 31.19 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.449 -0.881 . . . . 73.319999999999993 113.021 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.55 105.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.062 0.458 . . . . 74.409999999999997 109.799 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.536 HG22 ' H ' ' A' ' 66' ' ' SER . 7.4 p -74.74 146.74 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 115.419 -0.81 . . . . 72.310000000000002 110.413 -177.359 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -107.8 14.33 25.57 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.624 0.249 . . . . 74.409999999999997 110.401 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.536 ' H ' HG22 ' A' ' 64' ' ' VAL . 68.5 m 59.82 -147.95 0.46 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.758 -0.655 . . . . 65.540000000000006 110.012 -175.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -87.29 -179.87 6.49 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.47 -0.567 . . . . 75.239999999999995 109.47 174.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 63.19 72.12 0.49 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.478 0.656 . . . . 64.400000000000006 111.688 -175.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 66.2 m-70 -93.44 14.13 19.55 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.311 -0.859 . . . . 75.409999999999997 108.996 173.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -73.52 154.68 39.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.02 -0.991 . . . . 75.340000000000003 110.11 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -61.31 112.05 2.0 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.958 0.409 . . . . 73.040000000000006 111.097 177.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 84.7 m-70 -131.34 126.39 35.15 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.14 -0.689 . . . . 72.430000000000007 109.14 174.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.495 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 14.3 m-70 77.78 6.2 2.82 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.802 0.689 . . . . 73.549999999999997 111.962 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.465 -0.779 . . . . 75.420000000000002 110.13 -179.342 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.1 tpt . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 120.708 0.29 . . . . 63.340000000000003 110.222 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -121.38 149.93 42.25 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.81 -0.441 . . . . 73.329999999999998 109.81 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -129.02 151.81 49.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.457 -0.338 . . . . 73.109999999999999 110.558 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 m120 68.65 19.53 8.54 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.698 0.761 . . . . 72.140000000000001 110.67 172.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 47.5 tp -92.64 130.84 38.16 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.608 -1.178 . . . . 75.109999999999999 109.548 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -78.2 159.17 28.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.091 -0.504 . . . . 72.319999999999993 110.25 -178.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 72.69 36.68 58.13 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 110.778 -0.929 . . . . 74.25 110.778 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.582 ' HG3' ' HE2' ' A' ' 11' ' ' LYS . 17.5 tt0 -61.86 -29.74 70.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.541 0.21 . . . . 72.010000000000005 110.819 -177.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.427 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 19.1 t-105 -59.1 -49.33 78.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 74.409999999999997 109.88 173.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.4 ttm -61.6 -37.73 84.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.146 -0.479 . . . . 72.239999999999995 110.482 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.582 ' HE2' ' HG3' ' A' ' 8' ' ' GLU . 36.8 ttpt -56.93 -51.55 68.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.37 -0.832 . . . . 71.120000000000005 111.532 -178.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.402 HD22 ' HA ' ' A' ' 9' ' ' TRP . 11.1 p30 -78.18 -27.22 47.93 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.774 -0.37 . . . . 73.519999999999996 110.792 178.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -58.58 -46.05 87.78 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.492 -0.322 . . . . 74.329999999999998 111.351 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -65.16 -35.18 80.28 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 45.32 111.233 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.73 -33.66 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.278 0.561 . . . . 72.329999999999998 109.932 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.858 HD22 HD13 ' A' ' 58' ' ' LEU . 47.0 tp -80.89 -39.93 25.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.347 -0.842 . . . . 72.400000000000006 109.537 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -55.6 -43.61 76.2 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.719 -1.128 . . . . 74.219999999999999 110.19 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.4 m -72.04 -34.93 69.17 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.492 -0.776 . . . . 72.319999999999993 110.425 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.638 ' HA ' ' HD2' ' A' ' 22' ' ' LYS . 32.0 t80 -71.82 -41.34 68.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 74.5 110.964 -175.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.68 -39.29 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.446 -0.343 . . . . 74.349999999999994 110.137 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -24.69 67.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.417 0.627 . . . . 73.400000000000006 109.847 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.638 ' HD2' ' HA ' ' A' ' 19' ' ' PHE . 42.0 mttm -77.53 -68.97 0.57 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.561 -0.745 . . . . 75.530000000000001 111.599 -178.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 45.8 m-85 -120.86 -15.24 8.37 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.027 -0.269 . . . . 75.530000000000001 111.518 -171.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 23' ' ' TYR . 1.1 mpp_? 70.72 111.53 0.06 Allowed 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 123.947 0.78 . . . . 73.430000000000007 110.789 -171.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.605 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 22.0 ttt180 71.55 -178.25 0.21 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.724 -1.126 . . . . 75.430000000000007 110.23 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.49 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 3.6 m-85 -105.53 86.55 1.79 Allowed Pre-proline 0 C--N 1.33 -0.24 0 N-CA-C 111.541 0.2 . . . . 64.109999999999999 111.541 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.605 ' HD3' ' O ' ' A' ' 25' ' ' ARG . 13.9 Cg_exo -70.01 -29.4 22.73 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 121.948 1.765 . . . . 72.0 110.658 173.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.645 ' HG3' ' H ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -89.56 -61.05 1.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.036 -0.983 . . . . 75.030000000000001 111.213 177.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.645 ' H ' ' HG3' ' A' ' 28' ' ' LYS . 47.6 m 69.31 175.86 0.28 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.211 0.604 . . . . 72.310000000000002 111.067 -174.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.72 39.74 20.61 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.619 0.6 . . . . 75.409999999999997 112.619 177.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -143.22 141.46 31.09 Favored 'General case' 0 C--N 1.333 -0.147 0 O-C-N 122.307 -0.245 . . . . 74.540000000000006 111.387 178.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 67.56 -162.27 47.78 Favored Glycine 0 C--N 1.333 0.374 0 CA-C-N 115.86 -0.609 . . . . 70.510000000000005 113.023 175.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -69.99 -23.77 63.21 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.904 -0.776 . . . . 65.340000000000003 108.904 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.523 HD23 ' HB2' ' A' ' 16' ' ' LEU . 88.9 mt -66.06 -30.23 70.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.952 -1.022 . . . . 65.129999999999995 111.248 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -53.73 -40.93 64.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.058 -0.591 . . . . 64.510000000000005 112.151 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.47 -32.33 31.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.778 -0.725 . . . . 71.099999999999994 111.626 176.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.657 ' CZ2' ' HD3' ' A' ' 54' ' ' ARG . 26.2 t90 -54.15 -55.27 29.36 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.178 0.591 . . . . 72.239999999999995 111.126 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 7.1 p -67.12 -30.79 70.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.788 -0.642 . . . . 73.299999999999997 111.624 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -67.35 -36.47 81.47 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.763 0.282 . . . . 73.430000000000007 111.763 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.0 m -72.08 -45.08 62.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.156 0.503 . . . . 53.299999999999997 110.885 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.47 ' HG2' HD21 ' A' ' 50' ' ' LEU . 19.3 mt-30 -80.68 -10.46 59.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.119 -0.491 . . . . 74.209999999999994 111.458 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -56.27 -28.89 60.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.597 0.713 . . . . 75.209999999999994 109.429 171.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -88.08 -58.24 2.64 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.723 -1.126 . . . . 61.420000000000002 111.076 177.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.4 mmt -56.7 -33.02 66.04 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.747 -0.661 . . . . 75.329999999999998 112.105 -172.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.631 ' HA ' HD13 ' A' ' 50' ' ' LEU . 4.0 tmm_? -58.1 -50.53 73.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.324 -0.398 . . . . 75.109999999999999 111.115 -175.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -81.73 -16.59 50.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.011 0.434 . . . . 74.230000000000004 111.158 -174.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -99.65 3.64 45.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.141 -0.481 . . . . 74.230000000000004 111.483 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 64.0 27.17 70.94 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 120.779 -0.724 . . . . 75.349999999999994 112.315 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.713 ' HE2' ' HA ' ' A' ' 49' ' ' LYS . 10.3 mmpt? -99.34 -6.52 27.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.158 0.504 . . . . 73.200000000000003 109.85 -178.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.767 HD22 ' HD2' ' A' ' 51' ' ' PRO . 2.2 mt -62.32 141.02 96.4 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 115.161 -0.927 . . . . 72.510000000000005 110.258 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.767 ' HD2' HD22 ' A' ' 50' ' ' LEU . 64.5 Cg_endo -76.75 154.89 34.73 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.801 2.334 . . . . 62.119999999999997 112.997 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -71.76 -54.24 10.85 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.047 -0.979 . . . . 63.43 112.012 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.11 -34.88 64.06 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.023 0.44 . . . . 74.129999999999995 110.874 -175.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.657 ' HD3' ' CZ2' ' A' ' 37' ' ' TRP . 3.0 tmm_? -56.37 -42.85 78.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.403 -0.817 . . . . 73.510000000000005 110.134 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -67.0 -47.25 72.04 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 120.579 -0.448 . . . . 73.340000000000003 110.694 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.66 -39.82 91.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.931 -0.577 . . . . 53.149999999999999 110.993 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.1 mp -67.08 -37.05 83.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.109 -0.496 . . . . 72.319999999999993 110.958 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.858 HD13 HD22 ' A' ' 16' ' ' LEU . 3.8 mm? -67.78 -35.63 79.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.216 0.531 . . . . 65.510000000000005 110.411 176.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -64.51 -37.23 86.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.93 -0.577 . . . . 61.009999999999998 110.628 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -72.18 -31.88 66.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 74.209999999999994 112.19 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.778 HD13 HD11 ' A' ' 58' ' ' LEU . 25.1 pt -84.41 -12.92 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.598 -0.441 . . . . 62.409999999999997 110.751 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.28 34.85 4.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 72.530000000000001 113.534 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.416 ' CG ' HD12 ' A' ' 58' ' ' LEU . 81.0 t80 -74.49 126.51 30.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.893 0.378 . . . . 73.099999999999994 110.27 177.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.6 p -88.31 133.86 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-N 115.887 -0.597 . . . . 73.099999999999994 110.708 -178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 80.8 m95 -102.98 38.18 1.8 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.928 -0.578 . . . . 75.230000000000004 111.03 -176.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.1 p -86.73 110.3 19.81 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.097 -0.501 . . . . 60.210000000000001 111.031 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.7 mp -92.86 101.82 14.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.8 0.333 . . . . 72.140000000000001 110.525 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.41 -30.23 13.5 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.589 -0.523 . . . . 75.230000000000004 109.589 176.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -80.25 105.06 11.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.741 -0.663 . . . . 74.439999999999998 110.394 177.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -109.85 -168.09 1.28 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.94 -0.573 . . . . 73.409999999999997 109.555 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -132.02 116.31 16.92 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.941 0.4 . . . . 63.229999999999997 111.521 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 9.6 m80 -95.21 128.0 41.7 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.502 -0.925 . . . . 71.530000000000001 108.502 167.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 -69.09 124.25 23.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.812 0.339 . . . . 74.430000000000007 110.603 -173.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.3 m80 . . . . . 0 C--O 1.248 0.991 0 N-CA-C 109.182 -0.673 . . . . 74.099999999999994 109.182 174.857 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 109.229 -0.656 . . . . 74.25 109.229 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -80.44 -26.78 38.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.364 -0.38 . . . . 74.430000000000007 111.795 -174.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -93.34 144.46 25.3 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.945 0.403 . . . . 73.099999999999994 111.256 -174.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -93.47 152.28 19.18 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.738 -0.838 . . . . 73.109999999999999 108.738 172.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.7 tp -154.5 154.3 32.91 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.207 -0.294 . . . . 64.5 110.207 -175.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -61.66 115.8 4.25 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.455 -0.572 . . . . 75.120000000000005 109.455 172.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.49 45.0 0.75 Allowed Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 110.054 -1.218 . . . . 53.420000000000002 110.054 -172.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.586 ' HG3' ' HE2' ' A' ' 11' ' ' LYS . 28.5 tt0 -86.31 -12.5 49.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.079 -0.561 . . . . 75.219999999999999 110.786 -174.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.417 ' CH2' ' HD3' ' A' ' 54' ' ' ARG . 22.7 t-105 -55.55 -49.61 72.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.352 -0.386 . . . . 71.439999999999998 110.182 175.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.838 ' HA ' ' HE3' ' A' ' 10' ' ' MET . 2.5 tpt -55.73 -41.04 73.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.999 -0.546 . . . . 51.549999999999997 110.812 178.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.586 ' HE2' ' HG3' ' A' ' 8' ' ' GLU . 33.0 ttpt -67.33 -53.8 26.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 73.219999999999999 110.392 -178.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -61.25 -32.04 71.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 65.239999999999995 111.172 -179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.448 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.8 t80 -63.43 -41.3 98.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 73.150000000000006 110.24 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.462 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 35.1 mm-40 -62.47 -42.19 99.3 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.476 -0.329 . . . . 72.5 110.508 178.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.504 ' HB3' HD12 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -60.96 -49.63 76.66 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.168 0.509 . . . . 62.200000000000003 110.37 174.052 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.42 HD23 ' CD1' ' A' ' 58' ' ' LEU . 27.0 tp -56.4 -51.63 67.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.205 -0.907 . . . . 74.540000000000006 111.611 -177.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 49.4 mtpt -50.92 -54.28 25.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.226 0.536 . . . . 63.229999999999997 110.705 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.635 ' O ' ' HD3' ' A' ' 22' ' ' LYS . 13.4 t -62.43 -46.88 86.52 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.116 -0.947 . . . . 62.43 111.146 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.637 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 10.5 t80 -70.26 -43.24 70.91 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.627 -0.26 . . . . 74.140000000000001 111.544 -172.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.597 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 91.7 t -67.58 -38.44 80.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.987 -0.285 . . . . 70.439999999999998 110.821 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -59.46 -28.86 67.37 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.074 0.464 . . . . 75.239999999999995 109.935 176.684 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.635 ' HD3' ' O ' ' A' ' 18' ' ' SER . 5.1 mptp? -79.71 -66.83 0.82 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.87 -0.605 . . . . 63.399999999999999 111.586 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.417 ' CD2' ' HB3' ' A' ' 22' ' ' LYS . 85.1 m-85 -113.59 0.86 14.77 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.926 0.713 . . . . 75.340000000000003 112.926 -169.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.597 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 15.1 mmt85 64.52 9.28 4.92 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.006 0.522 . . . . 75.040000000000006 112.18 177.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.7 ptt180 -178.06 178.19 0.96 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.585 -0.524 . . . . 74.109999999999999 109.585 -174.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.637 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 8.9 m-85 -105.99 86.8 2.09 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 109.411 -0.589 . . . . 72.150000000000006 109.411 173.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.23 -48.79 4.31 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.663 2.242 . . . . 75.329999999999998 112.96 -173.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -78.48 -33.94 47.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.163 -0.471 . . . . 64.310000000000002 110.746 -176.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.429 ' C ' ' HG1' ' A' ' 30' ' ' THR . 8.9 t 65.12 -159.91 0.28 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.493 -0.776 . . . . 72.349999999999994 108.924 -172.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.429 ' HG1' ' C ' ' A' ' 29' ' ' SER . 67.9 p 59.93 5.16 0.69 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.125 0.97 . . . . 75.099999999999994 112.551 -176.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' ' 29' ' ' SER . 3.4 mp0 -64.43 129.85 41.5 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.321 -0.992 . . . . 75.010000000000005 108.321 168.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -52.76 -73.7 0.37 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 121.231 -0.509 . . . . 74.019999999999996 113.731 -173.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.401 HD22 ' HG2' ' A' ' 15' ' ' GLU . 29.8 p-10 -70.24 -47.18 62.52 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.027 0.38 . . . . 73.030000000000001 112.027 -175.372 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.557 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 95.3 mt -75.71 -34.48 60.38 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 112.685 0.624 . . . . 72.109999999999999 112.685 -173.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.03 -40.36 98.39 Favored Glycine 0 N--CA 1.451 -0.321 0 N-CA-C 111.559 -0.616 . . . . 73.299999999999997 111.559 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.15 -28.77 43.7 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.396 -0.907 . . . . 42.219999999999999 111.381 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.61 ' HH2' HD23 ' A' ' 58' ' ' LEU . 20.0 t90 -56.75 -55.86 28.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 71.140000000000001 110.914 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.518 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 8.3 p -63.4 -42.29 98.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.465 . . . . 70.030000000000001 111.152 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -65.2 -28.78 69.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.026 -0.533 . . . . 73.25 111.72 -177.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.5 m -83.86 -39.2 20.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.926 0.393 . . . . 65.0 110.835 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.61 -30.83 70.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.310000000000002 111.954 -178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -53.93 -38.86 65.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.1 0.476 . . . . 64.329999999999998 110.598 177.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.494 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 3.5 tmmm? -71.21 -37.06 72.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.579 -0.737 . . . . 74.420000000000002 111.035 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.5 mmt -62.5 -39.95 95.14 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.04 0.448 . . . . 73.340000000000003 110.655 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.482 ' N ' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -70.29 -48.36 57.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.615 -0.72 . . . . 74.140000000000001 110.55 -175.742 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.494 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 51.4 pttt -63.09 -24.95 68.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.123 0.487 . . . . 72.299999999999997 110.422 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -87.42 -1.33 57.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.863 -0.608 . . . . 74.150000000000006 111.169 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 58.74 30.92 66.57 Favored Glycine 0 N--CA 1.452 -0.269 0 CA-C-N 116.053 -0.521 . . . . 75.430000000000007 113.308 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.07 -0.8 11.03 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.607 -0.349 . . . . 73.510000000000005 111.501 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.747 HD22 ' HD2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -61.33 140.23 94.61 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.096 -0.502 . . . . 74.450000000000003 109.711 172.307 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.747 ' HD2' HD22 ' A' ' 50' ' ' LEU . 55.3 Cg_endo -73.83 150.21 43.88 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.23 1.954 . . . . 72.349999999999994 112.231 178.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -69.61 -30.19 67.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.42 -0.809 . . . . 72.230000000000004 110.36 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.645 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 6.4 m-20 -69.69 -51.78 31.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.547 -0.751 . . . . 74.219999999999999 109.846 -175.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.616 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -56.54 -53.53 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.963 -1.017 . . . . 74.319999999999993 111.147 179.147 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -65.69 -24.74 67.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.414 -0.357 . . . . 75.109999999999999 111.055 -176.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.99 -38.58 64.1 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.72 -0.474 . . . . 64.030000000000001 109.72 176.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.645 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 82.7 mt -59.34 -44.18 92.67 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.801 -0.636 . . . . 74.209999999999994 110.01 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.61 HD23 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -62.02 -43.01 99.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.665 -0.698 . . . . 71.120000000000005 110.876 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.42 -33.78 74.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.517 -0.311 . . . . 72.109999999999999 110.86 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -64.14 -41.24 97.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 73.420000000000002 111.418 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.428 HG13 HG13 ' A' ' 20' ' ' VAL . 13.1 pt -83.12 -5.95 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.884 0.374 . . . . 71.549999999999997 110.893 177.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.431 ' HA3' ' NH1' ' A' ' 24' ' ' ARG . . . 85.96 41.32 7.19 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.027 -0.606 . . . . 65.310000000000002 113.24 173.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.446 ' CG ' HD12 ' A' ' 58' ' ' LEU . 78.6 t80 -81.19 135.54 35.77 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.128 0.49 . . . . 74.049999999999997 110.856 178.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.5 t -90.26 123.22 42.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.578 -0.737 . . . . 61.219999999999999 110.299 176.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -83.21 -26.47 30.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.165 -0.471 . . . . 73.239999999999995 110.229 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.8 m 65.33 120.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.6 0.714 . . . . 72.439999999999998 111.898 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 49.3 tp -99.8 130.88 46.04 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.944 -0.571 . . . . 72.409999999999997 109.801 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.87 133.67 43.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.085 -0.507 . . . . 65.329999999999998 110.691 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -80.97 -178.68 6.99 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.933 -0.576 . . . . 73.329999999999998 111.892 -175.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -78.17 149.58 33.73 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.694 -0.685 . . . . 75.310000000000002 110.338 -177.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 45.7 m80 -93.27 152.61 19.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.52 -0.309 . . . . 70.400000000000006 110.265 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -85.56 71.58 10.73 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.241 0.46 . . . . 71.049999999999997 112.241 -170.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -175.73 150.04 1.01 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.715 -0.675 . . . . 55.530000000000001 109.534 173.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 58.9 m80 . . . . . 0 C--O 1.243 0.739 0 CA-C-O 118.271 -0.871 . . . . 65.25 109.785 175.63 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.44 -0.207 . . . . 75.040000000000006 110.44 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -142.63 148.58 37.66 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.847 -0.427 . . . . 72.209999999999994 109.847 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -98.99 50.72 0.96 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.732 -0.84 . . . . 70.129999999999995 108.732 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -75.75 -24.07 56.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.03 -0.986 . . . . 75.129999999999995 110.926 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.3 mt 63.4 -177.53 0.15 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.88 -0.6 . . . . 72.239999999999995 110.954 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 63.8 90.89 0.08 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.458 0.647 . . . . 71.049999999999997 110.864 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 141.08 54.91 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.448 -0.882 . . . . 71.340000000000003 112.665 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -85.41 -17.87 35.36 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.05 -0.352 . . . . 74.430000000000007 110.05 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.601 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -51.04 -56.37 12.88 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 108.913 -0.773 . . . . 75.030000000000001 108.913 174.134 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.826 ' HE2' ' HA ' ' A' ' 10' ' ' MET . 18.4 mmt -57.73 -34.78 69.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.551 -0.75 . . . . 74.310000000000002 111.419 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.515 ' HE3' ' OE1' ' A' ' 15' ' ' GLU . 18.8 ttpt -66.85 -52.93 37.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.392 -0.367 . . . . 65.099999999999994 110.059 178.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.45 -34.9 77.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.839 -0.619 . . . . 51.539999999999999 110.862 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -59.04 -50.24 74.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 71.209999999999994 110.519 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -63.98 -35.93 82.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.386 -0.37 . . . . 70.420000000000002 111.422 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.515 ' OE1' ' HE3' ' A' ' 11' ' ' LYS . 32.8 mt-10 -73.21 -34.86 66.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.472 -0.331 . . . . 73.019999999999996 110.745 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.699 HD22 HD23 ' A' ' 58' ' ' LEU . 39.4 tp -73.08 -42.28 63.18 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.732 -0.84 . . . . 73.549999999999997 108.732 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -52.2 -49.3 64.17 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.054 -1.43 . . . . 75.319999999999993 110.965 174.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -62.74 -38.06 89.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 54.210000000000001 110.501 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.35 -39.91 62.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.669 0.271 . . . . 74.349999999999994 111.247 -175.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.27 -34.37 66.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.94 0.4 . . . . 73.099999999999994 110.291 174.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -71.15 -39.22 72.08 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.987 0.422 . . . . 74.219999999999999 110.08 175.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -65.06 -61.2 2.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.594 -0.73 . . . . 74.239999999999995 112.463 -177.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -122.54 -7.28 8.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.005 0.372 . . . . 75.150000000000006 112.005 -171.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.428 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 2.6 mmm180 64.55 99.79 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 O-C-N 123.527 0.517 . . . . 73.340000000000003 109.904 -173.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.428 ' HB3' ' O ' ' A' ' 24' ' ' ARG . 74.7 ttt180 67.28 172.16 0.26 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.781 -0.645 . . . . 75.010000000000005 109.634 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -72.15 151.71 92.48 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 110.35 -0.241 . . . . 73.299999999999997 110.35 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.38 91.97 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.323 2.015 . . . . 45.210000000000001 110.13 171.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.6 tmtp? 63.96 -74.26 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.44 -0.8 . . . . 64.109999999999999 109.578 -169.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 p -176.51 14.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.842 0.353 . . . . 45.229999999999997 111.12 178.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.9 p -92.81 54.9 2.3 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.283 0.475 . . . . 74.340000000000003 112.283 -172.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.474 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -100.01 153.97 18.77 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.534 -0.543 . . . . 64.109999999999999 109.534 178.003 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -87.57 -76.54 1.27 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.939 -0.648 . . . . 73.239999999999995 112.383 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -63.71 -55.03 26.42 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.18 0.514 . . . . 74.239999999999995 110.666 -177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.79 -24.75 59.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 71.340000000000003 110.335 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.474 ' HA3' ' O ' ' A' ' 31' ' ' GLU . . . -59.78 -37.79 92.97 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.3 -0.864 . . . . 51.229999999999997 111.668 175.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.35 -33.34 53.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.493 -0.861 . . . . 53.509999999999998 111.663 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -63.88 -47.23 81.47 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.088 0.47 . . . . 74.340000000000003 110.637 -179.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.0 p -71.61 -30.21 65.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.196 -0.457 . . . . 73.349999999999994 111.28 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -53.33 -38.89 63.63 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.096 0.474 . . . . 75.209999999999994 110.891 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.3 m -73.28 -39.87 65.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 72.540000000000006 111.257 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.427 ' OE1' ' HD2' ' A' ' 54' ' ' ARG . 31.8 mt-30 -85.41 -21.15 28.91 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.014 0.746 . . . . 75.439999999999998 113.014 -171.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.451 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -66.05 -27.91 68.45 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 65.140000000000001 109.497 175.012 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.451 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 16.4 mtpp -67.83 -50.45 56.62 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.233 -0.654 . . . . 74.519999999999996 109.233 172.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.689 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 18.1 mmt -55.39 -37.66 67.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.015 -0.993 . . . . 72.040000000000006 110.916 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.784 ' HB2' HD13 ' A' ' 50' ' ' LEU . 4.2 tmm_? -77.17 -41.24 42.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 64.430000000000007 110.749 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.47 -40.45 93.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.281 0.562 . . . . 74.349999999999994 109.633 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.456 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 4.3 tp-100 -70.52 -29.24 65.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.68 -0.691 . . . . 64.129999999999995 110.346 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.5 35.8 9.17 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.83 -0.7 . . . . 61.219999999999999 112.228 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.456 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 17.7 ptmt -124.24 3.51 8.52 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.57 0.211 . . . . 64.319999999999993 111.57 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.784 HD13 ' HB2' ' A' ' 45' ' ' ARG . 4.0 mt -62.38 140.29 96.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.026 -0.361 . . . . 73.099999999999994 110.026 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.691 ' HG2' ' HB3' ' A' ' 54' ' ' ARG . 66.5 Cg_endo -75.6 135.1 17.6 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.708 2.272 . . . . 55.539999999999999 111.862 175.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.53 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 27.8 p-10 -69.56 -24.74 63.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.826 -0.625 . . . . 72.420000000000002 111.414 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.605 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 29.1 m-20 -64.92 -51.77 60.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.758 0.313 . . . . 75.439999999999998 110.686 177.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.691 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -62.94 -42.1 99.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 74.430000000000007 110.37 175.48 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.53 ' HB3' ' HA ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -53.27 -40.8 64.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.593 -0.73 . . . . 71.109999999999999 111.017 172.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -69.13 -44.69 71.86 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.973 -0.38 . . . . 75.299999999999997 109.973 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 85.8 mt -55.22 -47.3 75.55 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.254 -0.43 . . . . 75.549999999999997 111.282 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.699 HD23 HD22 ' A' ' 16' ' ' LEU . 39.0 mt -71.52 -37.86 71.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.975 -0.557 . . . . 73.540000000000006 110.77 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.56 ' HB2' ' HE1' ' A' ' 65' ' ' TRP . 22.7 t70 -69.86 -24.53 63.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.208 -0.451 . . . . 74.310000000000002 110.908 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -42.81 70.74 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 116.062 -0.517 . . . . 73.430000000000007 110.446 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 15.4 pt -73.49 -33.86 40.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 120.914 0.388 . . . . 74.030000000000001 110.343 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 131.6 33.47 0.44 Allowed Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.454 -0.879 . . . . 72.430000000000007 113.368 173.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -87.17 102.45 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.29 0.566 . . . . 70.150000000000006 109.52 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.8 p -75.86 128.47 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-N 115.112 -0.949 . . . . 70.200000000000003 110.89 -175.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.56 ' HE1' ' HB2' ' A' ' 59' ' ' ASP . 74.8 m95 -88.64 -31.73 18.4 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.639 -0.71 . . . . 74.310000000000002 110.846 -177.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.9 m 59.44 29.01 18.53 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.889 -0.596 . . . . 75.209999999999994 111.198 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -78.67 86.23 4.65 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.385 -0.598 . . . . 73.420000000000002 109.385 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -98.27 82.21 2.88 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.587 -0.733 . . . . 75.319999999999993 110.544 -176.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -97.67 124.98 42.2 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.983 0.42 . . . . 75.340000000000003 110.469 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -78.74 139.38 38.45 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.834 -0.621 . . . . 74.530000000000001 110.316 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -76.46 157.0 32.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.858 0.361 . . . . 74.409999999999997 111.24 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -154.0 148.06 25.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.958 -0.565 . . . . 74.439999999999998 109.601 174.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 24.2 t-80 -115.26 -11.77 11.91 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.412 0.625 . . . . 70.329999999999998 109.34 176.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 . . . . . 0 C--O 1.249 1.052 0 CA-C-N 115.321 -0.854 . . . . 75.019999999999996 109.377 176.587 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.4 ttm . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.124 -0.324 . . . . 75.109999999999999 110.124 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -135.53 114.18 11.82 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.671 0.272 . . . . 65.420000000000002 110.737 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -92.22 5.13 51.59 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.341 0.591 . . . . 54.450000000000003 109.698 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -68.9 120.88 15.5 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.239 -0.891 . . . . 62.329999999999998 109.859 174.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.6 mp -72.28 100.69 2.67 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.391 0.615 . . . . 74.409999999999997 111.369 -178.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.583 HE22 ' HB2' ' A' ' 11' ' ' LYS . 1.0 OUTLIER -150.61 143.34 24.56 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.246 -1.391 . . . . 71.420000000000002 107.246 176.21 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -48.79 104.79 0.1 OUTLIER Glycine 0 C--N 1.331 0.264 0 O-C-N 123.878 0.736 . . . . 73.409999999999997 113.418 -174.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.86 -51.83 59.92 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 120.442 0.163 . . . . 72.0 110.853 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -59.18 -45.59 90.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.467 -0.333 . . . . 72.510000000000005 110.669 -178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.801 ' HA ' ' HE3' ' A' ' 10' ' ' MET . 20.0 mmt -60.4 -39.96 89.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.065 0.46 . . . . 74.420000000000002 110.89 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.583 ' HB2' HE22 ' A' ' 6' ' ' GLN . 36.8 ttpt -69.5 -55.03 11.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 73.019999999999996 110.66 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -64.54 -33.35 75.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.706 -0.679 . . . . 73.400000000000006 111.933 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.441 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.7 t80 -59.08 -51.87 68.2 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 122.999 0.187 . . . . 74.420000000000002 110.503 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.799 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 73.6 mm-40 -59.6 -39.25 83.58 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.071 0.462 . . . . 73.109999999999999 111.016 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.516 ' CB ' HD23 ' A' ' 34' ' ' LEU . 52.8 mm-40 -66.15 -45.47 80.84 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 65.420000000000002 110.362 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.2 tp -62.98 -44.13 96.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.039 -0.528 . . . . 75.540000000000006 110.806 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.799 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.2 mtpt -50.99 -57.37 8.77 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.096 -0.502 . . . . 74.439999999999998 109.707 175.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -55.43 -42.76 74.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.049 -0.978 . . . . 61.119999999999997 111.951 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -62.67 -48.26 80.08 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.908 0.385 . . . . 65.239999999999995 111.353 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.712 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 32.9 t -72.3 -43.64 64.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.496 0.554 . . . . 75.519999999999996 112.496 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 17' ' ' LYS . 8.3 ppt_? -64.45 -15.76 61.26 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.954 -0.699 . . . . 75.319999999999993 110.848 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -87.25 -72.71 0.5 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.096 -0.502 . . . . 74.120000000000005 111.082 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -116.41 -6.87 11.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.32 0.489 . . . . 72.430000000000007 112.32 -170.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.712 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 12.1 mpt_? 66.05 13.71 9.23 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.851 0.46 . . . . 74.099999999999994 111.209 -176.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.619 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 12.7 ptt180 -161.94 175.61 11.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.586 0.231 . . . . 72.329999999999998 110.745 -175.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -104.45 87.83 1.88 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 73.099999999999994 110.744 175.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.619 ' HD3' ' O ' ' A' ' 25' ' ' ARG . 8.9 Cg_exo -70.91 -31.36 15.56 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.765 2.31 . . . . 73.420000000000002 111.739 -178.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -129.14 112.83 14.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.577 -0.738 . . . . 75.519999999999996 109.649 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.5 t -83.44 74.43 10.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.468 0.651 . . . . 73.219999999999999 110.586 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.2 p -109.81 4.78 22.06 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.754 0.788 . . . . 74.329999999999998 109.43 174.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.424 ' OE1' ' HB2' ' A' ' 33' ' ' ASN . 1.3 tm-20 -108.27 120.3 41.98 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.913 -1.04 . . . . 74.219999999999999 109.585 -177.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.63 -36.8 53.28 Favored Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 120.882 -0.675 . . . . 71.010000000000005 113.075 -175.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.424 ' HB2' ' OE1' ' A' ' 31' ' ' GLU . 90.1 m-20 -69.38 -54.62 13.54 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.598 -0.149 . . . . 71.409999999999997 110.598 -176.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.516 HD23 ' CB ' ' A' ' 15' ' ' GLU . 3.7 mm? -65.52 -32.01 73.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 74.450000000000003 110.642 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.19 -38.94 96.45 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.012 -0.614 . . . . 64.129999999999995 111.756 177.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.78 -31.53 35.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.33 -0.938 . . . . 74.219999999999999 111.561 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -58.79 -53.1 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.348 0.259 . . . . 75.420000000000002 111.063 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.7 p -62.25 -40.67 96.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.386 -0.37 . . . . 74.120000000000005 111.164 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -62.24 -45.58 92.67 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.871 0.367 . . . . 71.409999999999997 110.796 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.46 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 27.5 m -66.65 -38.38 86.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.894 -0.594 . . . . 73.109999999999999 110.856 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.574 ' HG3' HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.93 -20.95 60.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.108 -0.497 . . . . 71.310000000000002 111.513 -177.169 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -59.78 -43.9 94.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.729 0.299 . . . . 70.140000000000001 110.473 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -64.78 -41.54 95.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.318 -0.401 . . . . 75.030000000000001 110.097 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.536 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 25.3 mmt -57.77 -41.55 82.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.905 -0.589 . . . . 74.430000000000007 110.414 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.551 ' C ' ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -69.84 -49.68 50.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.698 -0.683 . . . . 73.209999999999994 111.045 -178.604 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -75.88 -22.5 56.08 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.881 -0.328 . . . . 73.430000000000007 111.324 -173.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.52 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 17.7 tt0 -85.3 -8.72 58.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.041 0.448 . . . . 74.430000000000007 110.19 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.18 37.62 63.55 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.695 -0.684 . . . . 60.409999999999997 112.409 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.52 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 14.2 ptmt -131.95 12.45 4.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.058 0.392 . . . . 74.310000000000002 112.058 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.574 HD23 ' HG3' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -63.43 135.32 96.2 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 108.527 -0.916 . . . . 75.019999999999996 108.527 176.391 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.743 ' HG2' HH11 ' A' ' 54' ' ' ARG . 20.5 Cg_exo -69.12 138.79 40.75 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.835 2.356 . . . . 74.109999999999999 113.109 -177.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.483 ' HA ' ' HG2' ' A' ' 55' ' ' ARG . 89.1 m-20 -69.51 -31.07 69.09 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.842 -1.072 . . . . 74.010000000000005 110.136 176.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.606 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 13.1 t70 -71.26 -47.9 54.26 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.531 -0.759 . . . . 74.120000000000005 110.144 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.743 HH11 ' HG2' ' A' ' 51' ' ' PRO . 3.2 ttm105 -61.95 -42.73 99.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 64.030000000000001 111.12 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.483 ' HG2' ' HA ' ' A' ' 52' ' ' ASN . 18.4 ptp180 -66.44 -31.92 72.97 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 109.745 -0.465 . . . . 72.239999999999995 109.745 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.16 -37.97 75.33 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.255 -0.429 . . . . 74.329999999999998 110.216 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.5 mt -59.84 -38.83 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 72.430000000000007 110.391 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.431 HD11 ' O ' ' A' ' 54' ' ' ARG . 9.9 mp -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 75.420000000000002 110.655 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.33 -36.56 82.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.814 0.34 . . . . 63.43 110.793 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -67.59 -40.01 84.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 74.040000000000006 111.671 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.437 HG21 ' HG2' ' A' ' 17' ' ' LYS . 33.6 pt -76.31 -14.03 14.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 120.579 -0.448 . . . . 65.510000000000005 110.877 178.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 110.74 20.16 7.42 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.624 -0.798 . . . . 61.409999999999997 113.582 173.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -68.32 130.67 43.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.299 0.571 . . . . 74.340000000000003 110.603 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.585 HG21 ' H ' ' A' ' 66' ' ' SER . 11.3 p -94.2 139.93 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 CA-C-N 115.203 -0.908 . . . . 73.019999999999996 109.801 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -86.31 16.65 4.26 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.979 0.419 . . . . 74.400000000000006 110.652 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.585 ' H ' HG21 ' A' ' 64' ' ' VAL . 21.6 t 66.41 -176.41 0.19 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.333 -0.849 . . . . 72.319999999999993 111.002 176.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -85.52 137.43 32.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.208 -0.451 . . . . 70.0 109.808 178.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -126.63 154.18 44.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.346 -0.388 . . . . 72.239999999999995 110.111 179.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -91.89 92.92 8.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.501 0.667 . . . . 73.349999999999994 109.223 171.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -100.11 123.98 44.98 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.125 -0.943 . . . . 71.450000000000003 109.35 -174.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -66.8 120.37 13.42 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.098 0.475 . . . . 75.109999999999999 110.037 -178.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -64.38 132.1 49.12 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.266 -0.879 . . . . 71.129999999999995 111.509 -172.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -94.34 -13.18 26.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.638 -0.71 . . . . 72.099999999999994 109.159 174.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 . . . . . 0 C--O 1.253 1.265 0 CA-C-O 118.413 -0.803 . . . . 64.109999999999999 109.001 174.069 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.3 tpp . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 121.188 0.518 . . . . 74.450000000000003 110.489 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -93.57 166.57 12.18 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.945 -0.571 . . . . 65.319999999999993 110.706 -178.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -144.47 163.97 32.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.921 -0.581 . . . . 74.319999999999993 110.008 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -124.71 167.19 14.9 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.27 -0.423 . . . . 72.409999999999997 110.304 -178.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 mt -70.08 -45.78 66.29 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.778 -0.823 . . . . 64.400000000000006 108.778 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -167.32 158.44 11.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.397 -1.274 . . . . 60.530000000000001 108.622 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.3 9.12 48.63 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.252 -0.975 . . . . 64.450000000000003 111.596 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.37 -18.97 61.11 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.03 -0.73 . . . . 73.239999999999995 109.03 176.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.58 ' HZ2' ' HA ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -50.11 -51.89 39.29 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.384 -0.826 . . . . 72.329999999999998 109.897 176.701 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.446 ' SD ' ' N ' ' A' ' 10' ' ' MET . 1.5 mpt? -60.78 -38.15 84.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.992 -0.549 . . . . 75.439999999999998 110.762 -177.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.538 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.7 OUTLIER -69.95 -48.45 58.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.79 -0.641 . . . . 75.439999999999998 109.939 179.767 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -63.95 -35.83 81.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.996 -0.547 . . . . 64.340000000000003 110.673 178.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -61.62 -54.94 36.2 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 115.737 -0.665 . . . . 71.439999999999998 110.135 -177.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -62.57 -29.57 70.68 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.885 -0.326 . . . . 74.519999999999996 111.321 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 46.0 mt-10 -65.31 -39.46 92.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.054 0.454 . . . . 72.099999999999994 110.312 175.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -87.66 -35.14 18.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.765 -0.652 . . . . 74.430000000000007 109.734 -173.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -58.68 -47.73 83.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.527 -0.76 . . . . 64.530000000000001 110.568 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.3 t -69.97 -26.94 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.919 -0.582 . . . . 73.319999999999993 110.202 178.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.477 ' HE1' ' HA ' ' A' ' 26' ' ' PHE . 37.9 t80 -75.14 -52.26 11.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.175 -0.466 . . . . 73.109999999999999 110.547 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.605 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 8.2 p -62.85 -33.79 62.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 73.109999999999999 111.984 -176.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -76.17 -20.07 57.87 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.005 -0.434 . . . . 75.319999999999993 111.001 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.423 ' HD3' ' CE2' ' A' ' 23' ' ' TYR . 62.9 tttm -95.49 -55.32 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.647 0.261 . . . . 75.230000000000004 111.069 -179.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.423 ' CE2' ' HD3' ' A' ' 22' ' ' LYS . 84.6 m-85 -93.84 -18.9 21.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.715 0.265 . . . . 65.040000000000006 111.715 -173.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.605 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 30.3 mmm180 64.0 87.07 0.11 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.489 0.662 . . . . 74.329999999999998 110.618 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 0.1 OUTLIER 68.89 176.19 0.27 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.417 -1.265 . . . . 72.409999999999997 111.208 -173.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.635 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 81.7 m-85 -74.85 143.54 78.31 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.529 -0.759 . . . . 73.439999999999998 110.455 175.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -72.82 -29.57 12.33 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.189 1.926 . . . . 65.530000000000001 110.563 171.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.448 ' HB3' ' H ' ' A' ' 29' ' ' SER . 3.6 tppp? -174.98 -85.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.93 -1.032 . . . . 73.0 109.372 178.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.448 ' H ' ' HB3' ' A' ' 28' ' ' LYS . 29.8 p 175.01 102.56 0.01 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.093 -0.958 . . . . 72.430000000000007 109.105 178.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.5 t -160.14 2.58 0.08 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.924 0.393 . . . . 75.530000000000001 111.276 -176.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.432 ' H ' ' CD ' ' A' ' 31' ' ' GLU . 1.3 pm0 -95.9 -166.7 1.47 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.292 -0.413 . . . . 62.399999999999999 110.45 -178.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -75.61 -118.19 0.12 Allowed Glycine 0 CA--C 1.52 0.403 0 C-N-CA 120.977 -0.63 . . . . 71.340000000000003 113.661 -173.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -59.84 -34.57 73.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.677 0.275 . . . . 50.439999999999998 111.654 -175.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.635 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 87.3 mt -60.81 -37.74 82.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.342 -0.39 . . . . 75.310000000000002 111.655 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.74 92.17 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.983 -0.627 . . . . 74.319999999999993 112.014 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.68 -38.96 12.73 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.719 -0.753 . . . . 72.299999999999997 111.68 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -55.17 -42.34 73.05 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 122.779 0.431 . . . . 71.430000000000007 111.097 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.1 t -65.98 -39.41 90.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.034 -0.53 . . . . 62.409999999999997 110.553 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -70.31 -37.26 74.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 72.230000000000004 111.727 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.6 m -68.93 -45.31 71.15 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.134 0.492 . . . . 74.540000000000006 110.838 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.715 ' HG3' HD23 ' A' ' 50' ' ' LEU . 2.8 mp0 -75.89 -17.24 59.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.085 -0.507 . . . . 71.310000000000002 111.588 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.5 tpt85 -59.87 -34.98 73.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.385 0.612 . . . . 72.010000000000005 109.863 173.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -74.14 -48.25 30.65 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.134 -0.939 . . . . 74.209999999999994 111.086 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.698 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.3 mmt -63.25 -29.57 70.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.885 -0.598 . . . . 72.439999999999998 110.987 -177.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -61.32 -50.39 73.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.836 -0.62 . . . . 74.400000000000006 111.172 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 46' ' ' LYS . 20.4 ptmt -77.2 -18.47 57.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.047 0.451 . . . . 71.310000000000002 111.038 -175.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -84.75 -13.77 50.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.099 -0.5 . . . . 73.219999999999999 110.492 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.99 25.49 75.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.926 -0.654 . . . . 72.310000000000002 112.176 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.447 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.0 ptmt -109.99 -0.95 17.91 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.104 0.478 . . . . 73.420000000000002 110.303 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.715 HD23 ' HG3' ' A' ' 41' ' ' GLN . 4.7 mt -62.2 140.79 96.17 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.59 -0.732 . . . . 72.150000000000006 109.917 175.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.48 ' HB2' ' HB3' ' A' ' 54' ' ' ARG . 23.9 Cg_exo -65.83 127.27 17.49 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.303 2.002 . . . . 75.120000000000005 110.747 172.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -59.04 -33.7 71.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.828 -0.623 . . . . 64.129999999999995 110.63 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.651 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 30.8 m-20 -65.5 -46.71 78.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.199 -0.455 . . . . 73.219999999999999 110.023 175.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.58 ' HA ' ' HZ2' ' A' ' 9' ' ' TRP . 31.8 tpt85 -56.42 -33.48 65.87 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.082 0.467 . . . . 74.239999999999995 110.869 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.446 ' HA ' ' CZ2' ' A' ' 65' ' ' TRP . 0.2 OUTLIER -73.15 -38.93 66.06 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.337 -0.392 . . . . 73.409999999999997 110.843 176.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.7 tp -76.34 -40.15 52.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.581 -0.281 . . . . 62.109999999999999 111.194 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.651 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 63.3 mt -59.31 -33.72 71.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.93 0.395 . . . . 74.540000000000006 111.042 -178.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.507 ' HG ' ' NH1' ' A' ' 54' ' ' ARG . 3.2 mm? -71.97 -43.86 64.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 71.340000000000003 110.446 176.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.039 -0.528 . . . . 70.209999999999994 110.26 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 59.7 mmtt -53.04 -46.94 68.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.467 -0.788 . . . . 70.230000000000004 110.991 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 7.4 pt -89.87 1.83 7.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.701 -0.681 . . . . 72.319999999999993 111.887 -174.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.21 24.44 8.95 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.323 -0.941 . . . . 51.43 113.666 174.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.446 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 34.9 t80 -89.41 101.45 14.13 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.535 -0.913 . . . . 74.140000000000001 108.535 173.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.2 p -81.53 128.42 38.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.281 -0.872 . . . . 62.039999999999999 111.916 -171.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.485 ' HB2' HD11 ' A' ' 67' ' ' LEU . 58.9 m95 -90.84 -17.54 26.36 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.68 -0.691 . . . . 74.030000000000001 109.624 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.2 m 71.63 -77.08 0.06 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.068 -0.969 . . . . 73.129999999999995 111.371 -179.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.485 HD11 ' HB2' ' A' ' 65' ' ' TRP . 4.0 mp 58.78 179.73 0.07 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.657 0.742 . . . . 63.219999999999999 111.667 -176.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -85.67 130.11 34.65 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.29 -1.004 . . . . 73.310000000000002 108.29 166.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -60.88 95.26 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.248 0.547 . . . . 71.510000000000005 112.299 -174.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -144.69 152.14 39.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.304 -0.862 . . . . 72.540000000000006 108.769 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -102.3 109.96 21.78 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.612 -0.514 . . . . 71.219999999999999 109.612 175.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -61.94 105.72 0.61 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.343 0.592 . . . . 75.310000000000002 110.292 -177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -131.1 138.69 49.64 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.476 -0.784 . . . . 75.230000000000004 109.997 -176.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.216 -0.897 . . . . 65.129999999999995 109.651 175.944 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.4 mtm . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 121.246 0.546 . . . . 75.109999999999999 110.531 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.1 m-20 -117.82 38.16 3.73 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.689 -0.687 . . . . 71.099999999999994 110.447 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -71.79 171.92 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.773 -0.649 . . . . 70.439999999999998 111.342 -178.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -85.3 155.03 21.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.12 -0.491 . . . . 74.310000000000002 111.026 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 6' ' ' GLN . 88.4 mt 69.88 -69.34 0.17 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.656 0.783 . . . . 73.219999999999999 113.035 173.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.427 ' HB2' ' O ' ' A' ' 5' ' ' LEU . 54.6 mt-30 71.87 149.19 0.09 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.742 0.817 . . . . 73.019999999999996 111.026 -172.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.76 66.17 3.64 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 121.014 -0.612 . . . . 51.32 111.811 -177.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -75.52 -17.03 60.21 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.214 -0.194 . . . . 70.340000000000003 110.9 -176.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -63.42 -49.91 71.88 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.14 -0.318 . . . . 72.120000000000005 110.14 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.826 ' HA ' ' HE3' ' A' ' 10' ' ' MET . 2.5 tpt -63.54 -34.92 78.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.101 0.477 . . . . 74.329999999999998 110.182 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.86 -48.21 39.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 73.400000000000006 110.556 -178.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -67.55 -39.47 84.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 64.349999999999994 111.465 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -62.83 -42.78 99.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.117 -0.233 . . . . 74.329999999999998 110.834 -176.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.99 -42.75 97.1 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.084 0.469 . . . . 64.109999999999999 110.869 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.99 -36.61 82.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.688 -0.687 . . . . 74.140000000000001 110.57 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 tp -81.96 -33.84 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 72.340000000000003 109.903 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -57.11 -52.05 66.85 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.699 -0.682 . . . . 70.319999999999993 109.999 175.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 m -68.51 -31.08 70.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.328 -0.851 . . . . 74.510000000000005 110.84 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -70.44 -50.63 36.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.428 -0.351 . . . . 64.209999999999994 110.316 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.607 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 71.8 t -68.74 -36.88 76.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 CA-C-N 116.634 -0.257 . . . . 63.030000000000001 111.078 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -31.61 72.91 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.676 -0.41 . . . . 75.299999999999997 110.89 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -94.41 -54.32 3.58 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.934 0.346 . . . . 74.299999999999997 111.934 -175.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -97.57 -9.38 27.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.605 0.24 . . . . 72.420000000000002 111.417 -175.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.607 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 25.5 mmt180 55.78 79.97 0.15 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.84 -0.618 . . . . 72.510000000000005 111.558 -174.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.727 ' HD3' HG13 ' A' ' 64' ' ' VAL . 22.6 mtt180 70.25 171.74 0.31 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.13 -0.941 . . . . 72.439999999999998 111.017 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.519 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.3 p90 -115.78 85.63 14.65 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 121.235 0.54 . . . . 75.400000000000006 110.474 172.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.19 100.72 1.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.645 2.23 . . . . 74.409999999999997 112.108 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.0 mttt 57.95 39.64 26.4 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.757 -0.656 . . . . 71.310000000000002 110.533 177.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.519 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 37.0 m -93.35 173.75 7.55 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.649 -0.705 . . . . 55.030000000000001 111.391 -176.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p -120.45 71.16 0.91 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.606 0.717 . . . . 64.420000000000002 109.788 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.547 ' H ' ' CD ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -94.61 177.41 5.93 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.023 -0.99 . . . . 72.329999999999998 111.106 -175.127 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -90.37 -114.04 1.63 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.109 -0.567 . . . . 61.109999999999999 113.566 -174.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -55.33 -41.32 72.3 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.848 0.356 . . . . 74.450000000000003 111.406 -175.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.28 -33.47 73.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.533 . . . . 75.239999999999995 111.217 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.433 ' N ' ' HG2' ' A' ' 31' ' ' GLU . . . -61.29 -49.79 73.92 Favored Glycine 0 CA--C 1.5 -0.869 0 C-N-CA 120.745 -0.74 . . . . 64.549999999999997 111.324 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.18 -31.24 71.81 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.561 -0.828 . . . . 43.229999999999997 111.139 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.638 ' HH2' HD23 ' A' ' 58' ' ' LEU . 7.7 t90 -56.17 -56.13 24.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.25 0.547 . . . . 74.450000000000003 109.954 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.3 t -71.19 -44.98 64.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.511 -0.768 . . . . 73.010000000000005 111.477 -177.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -57.68 -28.63 63.96 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.812 0.339 . . . . 73.140000000000001 111.635 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.1 m -84.38 -51.15 7.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.17 0.509 . . . . 71.019999999999996 111.162 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.49 ' HB3' HD12 ' A' ' 50' ' ' LEU . 61.1 mt-30 -76.6 -24.22 53.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.946 0.721 . . . . 74.349999999999994 112.946 -170.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.554 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 13.2 ttt180 -55.83 -42.53 75.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.474 0.654 . . . . 70.239999999999995 109.404 173.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -76.11 -32.13 59.03 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.577 -0.738 . . . . 61.119999999999997 110.075 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 14.8 mmt -60.53 -45.76 92.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.398 -0.364 . . . . 73.439999999999998 111.521 176.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.588 ' HB3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -65.58 -33.15 75.23 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.824 -0.35 . . . . 75.040000000000006 110.766 -177.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.445 ' HB2' HH11 ' A' ' 45' ' ' ARG . 5.2 tmmm? -73.87 -36.66 64.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.471 0.653 . . . . 72.540000000000006 109.53 176.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -73.56 -14.98 61.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.338 -0.846 . . . . 74.049999999999997 110.653 -178.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.616 ' C ' ' HE3' ' A' ' 49' ' ' LYS . . . 82.26 21.75 60.1 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.071 -0.585 . . . . 71.439999999999998 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.616 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 0.1 OUTLIER -95.09 -14.23 24.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.621 . . . . 41.299999999999997 110.535 -177.38 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.708 HD22 ' HD2' ' A' ' 51' ' ' PRO . 3.5 mt -93.6 141.74 24.25 Favored Pre-proline 0 C--N 1.315 -0.902 0 CA-C-N 115.315 -0.857 . . . . 73.540000000000006 110.248 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.708 ' HD2' HD22 ' A' ' 50' ' ' LEU . 83.7 Cg_endo -85.16 161.01 11.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.634 2.223 . . . . 65.439999999999998 111.736 170.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -71.35 -24.15 62.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.894 -0.594 . . . . 74.040000000000006 110.064 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.12 -51.75 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.734 -0.666 . . . . 74.239999999999995 111.192 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.4 ttm180 -67.87 -49.19 63.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.085 0.469 . . . . 74.209999999999994 110.376 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.519 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -50.41 -36.59 33.67 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.388 -0.824 . . . . 73.129999999999995 111.324 177.532 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.3 tp -68.35 -42.96 78.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 75.299999999999997 111.096 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.0 mp -62.35 -34.32 76.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.806 0.336 . . . . 72.219999999999999 110.869 178.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.638 HD23 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -65.65 -38.95 90.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.372 0.606 . . . . 71.109999999999999 110.473 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.519 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 12.4 t70 -64.94 -38.1 89.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.89 -0.595 . . . . 74.510000000000005 110.332 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -63.51 -41.7 98.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.775 -0.648 . . . . 74.319999999999993 111.969 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.452 HD13 HD11 ' A' ' 58' ' ' LEU . 35.3 pt -76.27 -16.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.563 -0.455 . . . . 63.009999999999998 110.906 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.67 33.6 3.28 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.731 -0.747 . . . . 45.539999999999999 112.984 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.42 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 48.0 t80 -93.79 133.78 36.81 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.072 0.463 . . . . 72.010000000000005 110.51 178.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.727 HG13 ' HD3' ' A' ' 25' ' ' ARG . 14.3 p -105.09 140.06 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-N 115.782 -0.644 . . . . 61.539999999999999 109.87 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -100.29 1.54 41.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.713 -0.222 . . . . 74.319999999999993 111.075 -177.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.627 ' H ' HG23 ' A' ' 64' ' ' VAL . 33.4 t 72.25 154.15 0.14 Allowed 'General case' 0 N--CA 1.465 0.321 0 O-C-N 124.022 0.827 . . . . 71.109999999999999 111.614 177.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.519 HD13 ' HB3' ' A' ' 70' ' ' HIS . 0.2 OUTLIER -80.3 -25.97 39.09 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.817 -0.809 . . . . 75.120000000000005 108.817 175.836 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 69.83 -71.25 0.13 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 114.778 -1.101 . . . . 74.109999999999999 112.85 174.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.433 ' O ' ' HB2' ' A' ' 70' ' ' HIS . 41.1 m80 -123.34 80.94 1.83 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.884 0.373 . . . . 75.120000000000005 111.731 -170.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.519 ' HB3' HD13 ' A' ' 67' ' ' LEU . 3.6 t-160 175.35 89.03 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.098 -0.955 . . . . 75.400000000000006 108.914 175.118 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -59.23 123.22 15.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.392 0.615 . . . . 75.329999999999998 111.142 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 62.4 m80 -80.72 142.64 33.65 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.477 -0.783 . . . . 65.099999999999994 109.307 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -120.4 149.17 42.78 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.833 -0.347 . . . . 73.340000000000003 110.858 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 60.2 m80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.351 -0.833 . . . . 75.120000000000005 109.703 179.439 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.6 mtt . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 120.683 0.278 . . . . 73.409999999999997 111.092 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -90.47 -24.86 20.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.629 0.252 . . . . 74.239999999999995 111.521 -177.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -103.09 108.57 19.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.031 0.443 . . . . 75.200000000000003 111.037 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -120.38 -53.82 2.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.595 -0.729 . . . . 72.329999999999998 109.534 175.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 85.7 mt 62.97 23.64 14.12 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.085 -0.961 . . . . 70.340000000000003 111.101 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -104.7 160.56 14.87 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.86 -0.609 . . . . 74.239999999999995 110.375 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.74 54.58 4.13 Favored Glycine 0 CA--C 1.517 0.192 0 C-N-CA 121.126 -0.559 . . . . 43.32 112.812 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -94.75 -33.29 12.95 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.061 -0.348 . . . . 71.150000000000006 110.061 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.494 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 23.8 t-105 -61.88 -44.72 96.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.042 -0.526 . . . . 70.120000000000005 111.866 -174.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.895 ' HA ' ' HE1' ' A' ' 10' ' ' MET . 12.0 mmt -54.35 -37.82 65.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.088 0.47 . . . . 65.219999999999999 111.131 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -79.36 -49.09 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.965 -0.561 . . . . 71.099999999999994 110.243 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -52.71 -47.25 67.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.924 -1.035 . . . . 63.329999999999998 111.464 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -54.72 -51.94 64.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.861 -0.608 . . . . 74.349999999999994 110.934 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -66.72 -36.5 82.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 72.310000000000002 111.687 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.99 -36.53 69.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.178 -0.464 . . . . 74.409999999999997 110.631 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.437 ' O ' HD21 ' A' ' 16' ' ' LEU . 4.2 tt -77.36 -35.69 54.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.188 -1.041 . . . . 75.439999999999998 108.188 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.65 -42.09 74.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.785 -1.098 . . . . 63.039999999999999 110.395 174.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -74.85 -29.95 61.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.631 -0.713 . . . . 72.349999999999994 110.925 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -75.4 -46.18 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 73.349999999999994 111.435 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.548 HG13 ' HB ' ' A' ' 61' ' ' ILE . 8.1 p -65.25 -34.15 68.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.573 -0.285 . . . . 72.049999999999997 111.205 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -78.86 -16.42 57.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.137 0.494 . . . . 73.450000000000003 110.147 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -77.8 -67.43 0.73 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.805 -0.634 . . . . 74.150000000000006 110.986 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -116.86 12.98 14.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.621 0.23 . . . . 75.219999999999999 111.621 -176.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.509 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 16.1 mmt180 62.31 88.26 0.09 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.722 0.639 . . . . 72.409999999999997 110.733 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.414 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 tmt_? 70.57 166.0 0.29 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.581 -0.736 . . . . 73.310000000000002 109.317 -177.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.485 ' HB2' ' O ' ' A' ' 29' ' ' SER . 8.8 p90 -113.52 86.83 10.74 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 121.151 0.501 . . . . 74.329999999999998 111.3 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -89.79 -4.62 5.4 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 123.117 2.545 . . . . 65.230000000000004 112.603 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -137.3 -45.96 0.56 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.044 -0.525 . . . . 70.310000000000002 109.811 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.485 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 5.3 m -69.67 141.32 53.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.42 -0.809 . . . . 72.319999999999993 109.844 175.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.3 p -122.29 -37.9 2.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.66 0.267 . . . . 70.150000000000006 111.17 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 67.75 1.36 2.61 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 122.068 0.937 . . . . 63.409999999999997 110.977 176.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.84 -70.5 2.72 Favored Glycine 0 C--N 1.307 -1.073 0 CA-C-N 115.187 -0.915 . . . . 39.100000000000001 112.273 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.02 -48.81 56.53 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.525 0.195 . . . . 72.340000000000003 111.525 -176.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.1 mt -58.63 -42.56 88.54 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.738 0.304 . . . . 74.129999999999995 111.066 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -57.81 -42.99 94.84 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.078 -0.582 . . . . 74.340000000000003 111.956 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.79 -39.8 76.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.848 -0.691 . . . . 65.129999999999995 111.528 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -54.64 -48.97 71.63 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.483 -0.562 . . . . 73.430000000000007 109.483 176.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -64.07 -51.42 64.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.134 -0.939 . . . . 74.439999999999998 110.877 178.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -52.72 -44.71 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.363 0.505 . . . . 63.340000000000003 112.363 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 46.0 m -70.9 -45.23 64.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.158 0.504 . . . . 73.140000000000001 111.264 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.457 ' HB3' HD21 ' A' ' 50' ' ' LEU . 33.9 mt-30 -86.44 -12.58 48.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.764 1.024 . . . . 72.439999999999998 113.764 -171.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.74 -4.73 36.37 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.297 0.57 . . . . 74.340000000000003 109.952 174.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.711 ' HD3' ' HG3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -92.67 -47.78 6.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.504 -0.771 . . . . 73.239999999999995 108.982 172.299 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.744 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 12.5 mmt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.573 -0.739 . . . . 75.209999999999994 111.231 -175.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.645 ' HG3' ' N ' ' A' ' 46' ' ' LYS . 14.1 ptt180 -52.37 -49.34 64.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.991 -0.55 . . . . 74.450000000000003 111.519 -178.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.645 ' N ' ' HG3' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -82.2 -43.7 17.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.867 -0.606 . . . . 71.329999999999998 109.854 -175.513 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.711 ' HG3' ' HD3' ' A' ' 43' ' ' LYS . 10.9 mm-40 -60.91 -18.0 54.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.378 -0.828 . . . . 73.310000000000002 111.688 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.24 36.24 24.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.924 -0.655 . . . . 75.150000000000006 111.522 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.744 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 9.8 mmpt? -108.65 -10.25 15.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 71.5 110.066 -177.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.636 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 11.0 mt -75.38 142.6 75.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 74.109999999999999 111.226 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -70.92 137.92 33.06 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.745 2.296 . . . . 74.140000000000001 110.947 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.579 ' HA ' ' CG ' ' A' ' 55' ' ' ARG . 74.3 m-20 -63.82 -22.49 66.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.613 -0.721 . . . . 75.209999999999994 111.965 -177.479 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.756 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 20.2 m-20 -64.27 -52.74 57.18 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.445 -0.576 . . . . 64.329999999999998 109.445 179.179 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -63.8 -47.12 82.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.662 -0.699 . . . . 75.310000000000002 111.295 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.579 ' CG ' ' HA ' ' A' ' 52' ' ' ASN . 7.7 ppt_? -65.51 -23.65 66.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.003 0.43 . . . . 75.430000000000007 110.539 -175.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.6 tp -82.35 -37.43 25.68 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.816 -0.438 . . . . 62.200000000000003 109.816 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 41.4 mt -66.39 -43.75 84.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 73.200000000000003 110.538 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.7 mt -64.32 -44.07 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.128 -0.487 . . . . 73.150000000000006 110.621 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -68.88 -20.39 64.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.17 0.51 . . . . 75.109999999999999 110.353 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -79.55 -39.73 31.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.802 -0.635 . . . . 75.239999999999995 110.767 177.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.548 ' HB ' HG13 ' A' ' 20' ' ' VAL . 19.4 pt -80.99 -9.8 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.662 0.268 . . . . 72.030000000000001 111.366 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.76 6.44 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.624 -0.798 . . . . 43.049999999999997 112.816 175.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -84.07 120.48 26.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.09 0.471 . . . . 71.5 110.309 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 15.0 p -77.42 131.14 35.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.34 -0.845 . . . . 62.409999999999997 110.068 178.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.489 ' HZ2' ' HA ' ' A' ' 55' ' ' ARG . 94.6 m95 -90.2 -19.35 24.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.196 -0.456 . . . . 74.409999999999997 112.138 -173.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.7 m 62.81 26.95 15.85 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 122.065 0.936 . . . . 74.510000000000005 109.031 -172.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 47.3 tp -138.8 159.22 42.64 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.359 -1.292 . . . . 73.099999999999994 108.006 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.22 100.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.103 0.478 . . . . 72.400000000000006 111.522 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -77.82 79.59 4.3 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.681 -0.859 . . . . 71.310000000000002 108.681 174.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -131.67 -64.42 0.79 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.657 -0.701 . . . . 71.129999999999995 110.533 -175.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.4 t-80 68.57 150.11 0.07 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 124.071 0.857 . . . . 74.430000000000007 109.593 -173.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -74.24 81.44 1.83 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.49 0.662 . . . . 75.099999999999994 111.058 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -98.7 -15.32 19.42 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.371 -0.831 . . . . 74.230000000000004 108.815 174.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 61.6 t60 . . . . . 0 C--O 1.244 0.792 0 CA-C-N 114.76 -1.109 . . . . 72.239999999999995 109.089 178.818 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.879 -0.415 . . . . 73.049999999999997 109.879 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -110.03 103.94 12.75 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.806 -0.442 . . . . 72.439999999999998 109.806 176.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -74.08 115.99 14.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.235 0.541 . . . . 74.109999999999999 110.844 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -126.97 -157.75 0.83 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.66 -0.7 . . . . 73.25 109.149 179.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 tt -89.58 77.53 7.19 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.92 -0.77 . . . . 72.540000000000006 108.92 175.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.423 ' NE2' ' H ' ' A' ' 6' ' ' GLN . 0.6 OUTLIER -116.19 131.34 56.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.15 0.5 . . . . 61.009999999999998 110.218 177.787 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -84.34 50.84 4.47 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.746 -0.661 . . . . 74.310000000000002 112.551 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.73 -14.29 61.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.131 -0.322 . . . . 43.219999999999999 110.131 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.483 ' HZ2' HD13 ' A' ' 57' ' ' LEU . 11.7 t-105 -57.52 -46.46 83.79 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 121.298 0.57 . . . . 70.409999999999997 109.981 173.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.872 ' HA ' ' HE1' ' A' ' 10' ' ' MET . 15.2 mmt -66.1 -23.95 66.6 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.967 -0.561 . . . . 64.140000000000001 110.791 177.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 -51.49 9.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.065 -0.516 . . . . 74.109999999999999 110.379 179.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -78.1 -25.22 47.44 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.579 0.585 . . . . 71.329999999999998 112.579 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -62.46 -52.51 63.22 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 121.096 -0.242 . . . . 74.329999999999998 110.727 177.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 10' ' ' MET . 8.4 pt-20 -68.45 -25.26 64.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.349 0.595 . . . . 74.450000000000003 110.157 177.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -68.66 -31.83 71.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.363 -0.835 . . . . 70.349999999999994 109.844 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.542 HD22 ' CZ3' ' A' ' 37' ' ' TRP . 41.2 tp -88.81 -39.27 14.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.312 0.577 . . . . 75.510000000000005 109.571 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.543 ' HG3' HG23 ' A' ' 61' ' ' ILE . 59.2 tttm -53.29 -51.85 60.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.888 -1.051 . . . . 74.25 111.284 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.6 p -61.14 -33.53 73.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.68 -0.691 . . . . 75.319999999999993 111.463 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.538 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 14.5 t80 -75.38 -49.67 18.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.847 0.356 . . . . 75.129999999999995 110.389 -178.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.9 t -63.17 -36.18 74.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.177 -0.465 . . . . 63.420000000000002 110.666 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -53.83 -30.39 45.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.07 -0.514 . . . . 72.540000000000006 110.954 178.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -92.33 -56.03 3.19 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.879 -0.6 . . . . 73.140000000000001 112.042 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.94 -29.15 11.6 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 120.874 0.369 . . . . 65.540000000000006 111.113 -171.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.568 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.1 OUTLIER 62.3 104.28 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.218 -0.901 . . . . 71.209999999999994 110.192 -164.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.5 mmt180 77.79 153.3 0.14 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.572 -1.195 . . . . 73.409999999999997 111.625 -177.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.538 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 6.5 p90 -132.09 88.38 41.04 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 114.627 -1.169 . . . . 72.140000000000001 109.054 177.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.34 70.89 0.43 Allowed 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 122.82 2.347 . . . . 73.340000000000003 112.278 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.1 mttm 62.84 38.51 11.48 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.582 -0.735 . . . . 71.549999999999997 110.165 179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.1 m -57.75 -74.93 0.05 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.263 -0.881 . . . . 72.420000000000002 111.935 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.5 p -112.48 -35.66 5.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.006 0.432 . . . . 73.120000000000005 110.525 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.957 ' HA ' ' HA3' ' A' ' 35' ' ' GLY . 41.3 mt-10 57.59 34.33 24.41 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.434 -0.803 . . . . 72.549999999999997 111.995 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -82.01 -104.86 0.4 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.427 -0.892 . . . . 72.439999999999998 111.322 173.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -62.88 -55.92 21.85 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.329 0.585 . . . . 71.329999999999998 110.948 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 98.2 mt -74.37 -32.08 62.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.37 -0.832 . . . . 72.019999999999996 111.104 -174.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.957 ' HA3' ' HA ' ' A' ' 31' ' ' GLU . . . -61.19 -43.57 99.23 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.335 -0.936 . . . . 64.010000000000005 111.218 177.032 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.37 -30.73 66.61 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 110.986 -0.845 . . . . 60.210000000000001 110.986 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.7 ' O ' HG22 ' A' ' 40' ' ' THR . 2.1 t90 -63.79 -46.44 85.17 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.441 -0.577 . . . . 74.430000000000007 109.441 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.475 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.3 t -60.1 -45.42 93.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.089 -0.505 . . . . 74.530000000000001 110.324 176.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.41 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 74.4 m-70 -61.52 -32.43 72.48 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.277 -0.419 . . . . 73.329999999999998 111.988 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.701 ' O ' ' HG2' ' A' ' 44' ' ' MET . 1.3 t -71.05 -39.28 72.36 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 120.438 -0.505 . . . . 75.019999999999996 110.049 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.18 -27.57 61.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.859 0.361 . . . . 62.439999999999998 110.646 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.41 ' HB3' ' O ' ' A' ' 39' ' ' HIS . 21.3 tpt180 -54.98 -44.23 74.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.67 -0.695 . . . . 70.209999999999994 109.435 171.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 40' ' ' THR . 20.7 mtpp -71.79 -57.03 4.7 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.09 -0.959 . . . . 75.230000000000004 110.406 177.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.701 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.0 mmt -54.63 -33.99 61.42 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.808 -0.633 . . . . 71.049999999999997 111.973 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.856 ' HB2' HD11 ' A' ' 50' ' ' LEU . 23.9 tpt180 -74.14 -47.98 32.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.738 0.304 . . . . 65.140000000000001 110.334 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.475 ' HB3' ' HE2' ' A' ' 46' ' ' LYS . 5.1 tmmm? -64.99 -29.95 70.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.173 0.511 . . . . 72.540000000000006 110.162 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -79.23 -20.72 47.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.843 -0.617 . . . . 74.0 110.647 176.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 77.34 49.76 7.17 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.684 -0.689 . . . . 43.210000000000001 113.165 176.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.616 ' HD2' ' SD ' ' A' ' 44' ' ' MET . 0.1 OUTLIER -143.32 11.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.951 0.405 . . . . 61.310000000000002 111.915 177.678 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.856 HD11 ' HB2' ' A' ' 45' ' ' ARG . 5.7 mt -69.78 140.97 89.46 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.06 -0.518 . . . . 71.349999999999994 110.329 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.479 ' HD2' ' CD2' ' A' ' 50' ' ' LEU . 76.8 Cg_endo -80.63 144.92 16.0 Favored 'Trans proline' 0 C--O 1.239 0.535 0 C-N-CA 122.805 2.336 . . . . 73.439999999999998 113.047 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -65.5 -44.72 86.16 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.846 -1.07 . . . . 73.340000000000003 111.749 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.69 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 8.6 m-20 -54.78 -52.5 62.4 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.313 -0.403 . . . . 74.549999999999997 111.528 -175.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.546 ' HB3' HH11 ' A' ' 54' ' ' ARG . 3.1 ttp-105 -57.01 -46.0 82.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 65.310000000000002 110.697 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.72 -50.15 69.02 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.041 -0.981 . . . . 73.019999999999996 109.968 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.1 tp -67.64 -34.38 76.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 73.030000000000001 111.618 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.69 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.4 mt -62.61 -31.86 72.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 75.299999999999997 110.874 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt -71.67 -36.98 70.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.065 0.46 . . . . 75.430000000000007 110.443 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.22 -33.93 72.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.211 -0.449 . . . . 72.310000000000002 110.545 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -69.42 -31.78 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 71.019999999999996 111.881 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.543 HG23 ' HG3' ' A' ' 17' ' ' LYS . 38.9 pt -86.81 -7.13 10.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.653 -0.419 . . . . 74.209999999999994 110.903 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.21 22.81 12.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.659 -0.782 . . . . 71.150000000000006 112.77 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -82.9 108.12 16.0 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.246 0.546 . . . . 74.530000000000001 110.104 178.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.1 p -78.89 142.6 13.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 73.239999999999995 110.641 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.473 ' HA ' HH21 ' A' ' 25' ' ' ARG . 94.6 m95 -98.28 -36.5 9.99 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.43 -0.35 . . . . 74.209999999999994 110.288 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.7 t 64.29 -166.03 0.23 Allowed 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.841 0.713 . . . . 53.109999999999999 110.529 178.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.412 ' N ' HD12 ' A' ' 67' ' ' LEU . 5.3 mp -119.59 148.04 43.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.566 -0.288 . . . . 72.120000000000005 110.495 -177.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.483 ' HG2' ' N ' ' A' ' 69' ' ' HIS . 29.4 tt0 -153.9 157.98 40.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.106 -0.497 . . . . 73.409999999999997 110.28 -179.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.483 ' N ' ' HG2' ' A' ' 68' ' ' GLU . 28.8 m170 68.08 20.0 9.12 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.125 0.57 . . . . 74.239999999999995 111.878 173.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -118.87 155.07 31.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.56 -0.533 . . . . 61.340000000000003 109.56 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -174.1 -51.84 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.933 -0.766 . . . . 72.019999999999996 108.933 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -172.91 -39.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.451 -0.795 . . . . 74.420000000000002 109.627 173.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -84.93 166.68 16.6 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.658 -0.497 . . . . 74.010000000000005 109.658 174.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 11.6 p80 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.394 -0.812 . . . . 75.439999999999998 110.284 -179.765 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.409 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 110.107 -0.331 . . . . 73.049999999999997 110.107 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -128.39 112.47 14.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.178 -0.464 . . . . 73.049999999999997 110.063 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -116.84 14.54 15.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.97 0.414 . . . . 75.109999999999999 111.035 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -98.29 -19.86 17.56 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.85 -0.796 . . . . 74.420000000000002 108.85 172.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.1 mt -133.94 124.28 26.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.656 -1.156 . . . . 73.129999999999995 108.928 174.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -74.41 -50.03 20.12 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.943 0.401 . . . . 71.129999999999995 110.142 -176.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -97.84 39.45 2.77 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.783 -0.722 . . . . 61.219999999999999 112.004 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.474 ' OE2' ' HB3' ' A' ' 12' ' ' ASN . 4.2 tm-20 -66.47 -39.21 88.68 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.881 -0.414 . . . . 75.439999999999998 109.881 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.64 ' HZ2' HD11 ' A' ' 57' ' ' LEU . 18.5 t-105 -51.82 -57.03 10.5 Favored 'General case' 0 C--N 1.334 -0.105 0 O-C-N 123.513 0.508 . . . . 75.430000000000007 111.278 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 45.2 ttm -58.25 -35.02 71.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.748 0.309 . . . . 73.200000000000003 110.875 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.457 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.6 tmmt? -69.36 -55.47 10.29 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.187 -0.46 . . . . 75.209999999999994 110.921 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.501 HD22 ' HA ' ' A' ' 9' ' ' TRP . 11.8 p30 -66.09 -32.69 74.29 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 120.513 -0.475 . . . . 75.230000000000004 111.206 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.597 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 36.3 t80 -63.71 -45.75 88.56 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.279 . . . . 74.329999999999998 110.672 -179.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 38.7 mm-40 -58.97 -35.1 72.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.812 0.339 . . . . 71.25 111.287 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -75.45 -40.03 58.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.257 0.551 . . . . 72.540000000000006 110.041 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.418 HD11 HD21 ' A' ' 34' ' ' LEU . 47.0 tp -64.5 -40.25 95.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.281 -0.872 . . . . 73.329999999999998 111.597 -178.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.597 ' HG3' ' O ' ' A' ' 13' ' ' TYR . 55.2 mtpt -51.32 -57.71 8.16 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.348 0.594 . . . . 65.510000000000005 110.388 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.1 m -63.06 -37.05 85.63 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.915 -1.039 . . . . 62.310000000000002 111.336 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.524 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 11.2 t80 -65.73 -47.16 76.27 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.932 0.396 . . . . 74.340000000000003 110.621 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 40.2 t -67.76 -34.37 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.207 -0.451 . . . . 72.420000000000002 111.193 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -69.76 -39.83 76.48 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 120.928 -0.309 . . . . 74.519999999999996 110.367 178.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.67 -52.59 11.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.391 . . . . 73.150000000000006 111.406 -174.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -96.31 -20.82 18.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.017 0.377 . . . . 74.349999999999994 112.017 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.628 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 18.8 mmt180 63.47 92.99 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 72.239999999999995 110.158 -169.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.628 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 15.1 ptt-85 61.18 169.84 0.1 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.542 -1.208 . . . . 74.010000000000005 111.298 -176.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.805 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.8 p90 -141.04 86.65 11.34 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-O 121.517 0.675 . . . . 74.239999999999995 110.754 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -71.23 -39.51 3.86 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.116 2.544 . . . . 74.450000000000003 113.02 -175.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -115.71 5.53 14.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.805 0.336 . . . . 71.239999999999995 111.303 -174.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.805 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 13.8 m -87.82 114.87 24.84 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.094 0.473 . . . . 75.120000000000005 110.747 -177.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.555 ' HA ' ' CA ' ' A' ' 35' ' ' GLY . 13.1 t -119.09 23.52 11.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.518 0.675 . . . . 72.340000000000003 110.186 -179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -72.81 139.0 46.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.307 -0.86 . . . . 73.420000000000002 111.808 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 57.54 -152.44 26.33 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.388 -0.823 . . . . 74.049999999999997 113.572 174.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -69.81 -27.84 65.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.82 -0.19 . . . . 71.209999999999994 110.769 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.418 HD21 HD11 ' A' ' 16' ' ' LEU . 81.1 mt -61.4 -38.93 88.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.816 0.341 . . . . 71.510000000000005 110.914 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.555 ' CA ' ' HA ' ' A' ' 30' ' ' THR . . . -58.72 -42.97 96.63 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.895 -0.669 . . . . 72.040000000000006 112.358 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -82.21 -26.71 47.16 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.275 -0.964 . . . . 53.240000000000002 111.293 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.41 ' CZ2' ' HZ3' ' A' ' 9' ' ' TRP . 5.2 t90 -56.58 -56.43 21.47 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 122.951 0.5 . . . . 75.420000000000002 110.584 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.7 p -65.09 -37.06 86.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.839 -0.619 . . . . 74.310000000000002 111.579 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 24.1 m80 -73.62 -40.46 63.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 74.450000000000003 111.908 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.491 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 95.9 m -63.65 -38.07 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.006 0.431 . . . . 74.530000000000001 110.966 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.946 ' HG2' HD22 ' A' ' 50' ' ' LEU . 7.9 mt-30 -76.55 -9.62 58.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.237 -0.438 . . . . 64.140000000000001 112.089 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 39' ' ' HIS . 5.1 mpt_? -62.41 -38.98 91.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.658 -0.497 . . . . 75.430000000000007 109.658 171.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -72.37 -37.37 68.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.635 -0.711 . . . . 73.519999999999996 110.34 179.189 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.817 ' HA ' ' HE3' ' A' ' 44' ' ' MET . 16.9 mmt -71.32 -34.81 70.9 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 52.0 110.635 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.2 ttt-85 -63.89 -45.27 90.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.45 0.643 . . . . 64.109999999999999 109.635 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.6 tttp -61.93 -49.09 77.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.541 -1.209 . . . . 61.119999999999997 111.146 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -63.77 -31.07 72.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.703 -0.68 . . . . 60.439999999999998 110.352 177.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.89 32.24 15.41 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.745 -0.661 . . . . 71.129999999999995 112.712 176.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.5 ptmt -121.98 7.16 9.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.792 0.329 . . . . 61.240000000000002 111.025 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.946 HD22 ' HG2' ' A' ' 41' ' ' GLN . 4.6 mt -60.02 138.81 90.99 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.825 -0.625 . . . . 72.140000000000001 110.656 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 32.3 Cg_exo -61.08 131.86 38.94 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.183 2.588 . . . . 74.319999999999993 112.965 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.4 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 8.0 t30 -72.18 -39.66 68.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.355 -0.838 . . . . 64.310000000000002 111.374 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.677 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 50.7 m-20 -58.29 -53.83 53.83 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.148 0.499 . . . . 64.140000000000001 110.069 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.533 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -59.44 -39.82 84.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.254 -0.884 . . . . 75.030000000000001 110.738 176.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.427 ' HA ' ' HZ2' ' A' ' 65' ' ' TRP . 11.4 ttt180 -55.85 -50.32 70.92 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.931 -0.577 . . . . 71.209999999999994 110.6 177.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -67.81 -36.24 80.06 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.467 -0.788 . . . . 75.230000000000004 110.548 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.677 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 59.4 mt -62.19 -33.59 74.84 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.259 -0.428 . . . . 75.010000000000005 110.822 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 54' ' ' ARG . 56.8 mt -71.47 -41.35 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.138 0.494 . . . . 73.299999999999997 110.377 178.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.96 -32.01 73.53 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.132 -0.485 . . . . 72.409999999999997 110.257 177.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -58.87 -47.64 84.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.879 -0.601 . . . . 65.120000000000005 111.668 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.557 HG23 ' HG2' ' A' ' 17' ' ' LYS . 30.2 pt -77.71 -9.72 12.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.839 0.352 . . . . 74.430000000000007 111.488 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.25 14.09 19.39 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.537 -0.839 . . . . 65.5 113.53 174.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -72.57 124.19 24.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.834 -0.432 . . . . 74.430000000000007 109.834 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.585 HG21 ' H ' ' A' ' 66' ' ' SER . 14.4 p -86.09 134.14 28.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.929 -0.578 . . . . 74.409999999999997 110.831 -176.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.427 ' HZ2' ' HA ' ' A' ' 55' ' ' ARG . 94.6 m95 -92.24 20.32 6.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.975 -0.557 . . . . 73.209999999999994 111.263 -178.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.585 ' H ' HG21 ' A' ' 64' ' ' VAL . 14.4 m 71.26 123.87 0.03 OUTLIER 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.223 -0.899 . . . . 62.409999999999997 112.135 174.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.4 mp -73.4 -173.73 1.47 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.88 -0.6 . . . . 75.409999999999997 109.484 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 59.06 75.01 0.42 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.341 -0.985 . . . . 72.040000000000006 108.341 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -118.96 117.78 29.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.037 -0.983 . . . . 71.420000000000002 110.675 -170.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -107.31 158.59 17.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.641 -0.254 . . . . 74.310000000000002 110.873 179.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 27.9 m80 -103.67 143.52 32.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.131 -0.486 . . . . 75.010000000000005 111.066 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -171.15 137.54 1.16 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.03 -0.729 . . . . 71.510000000000005 109.03 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -156.8 76.37 0.87 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.298 0.571 . . . . 75.349999999999994 111.95 -177.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.402 -0.809 . . . . 73.230000000000004 109.427 175.819 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.2 mtt . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 120.548 0.214 . . . . 64.209999999999994 110.823 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -67.88 -42.52 81.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.085 0.469 . . . . 74.400000000000006 110.184 174.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -138.19 144.47 40.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.735 -0.666 . . . . 75.200000000000003 109.881 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -117.68 -19.74 9.21 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.981 0.42 . . . . 74.319999999999993 110.463 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.8 mt -113.73 153.54 28.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.079 -0.51 . . . . 71.109999999999999 110.237 178.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 63.19 50.78 2.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.59 -0.732 . . . . 70.319999999999993 110.792 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -71.98 71.75 0.93 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.044 -0.598 . . . . 64.510000000000005 111.811 174.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -57.5 -26.21 60.97 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 122.973 0.509 . . . . 74.420000000000002 111.377 -176.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.475 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 2.9 t-105 -57.45 -42.2 82.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.113 -0.494 . . . . 73.209999999999994 111.057 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.823 ' HA ' ' HE1' ' A' ' 10' ' ' MET . 2.9 tpt -59.18 -41.03 87.5 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.25 0.548 . . . . 61.539999999999999 110.572 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -70.27 -57.86 4.4 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.257 -0.883 . . . . 73.129999999999995 110.791 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -54.38 -32.0 56.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.989 -1.005 . . . . 72.319999999999993 111.241 -179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.643 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 63.8 t80 -58.41 -55.27 37.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.23 -0.441 . . . . 61.240000000000002 110.655 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.767 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 68.2 mm-40 -64.5 -36.73 85.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 64.129999999999995 111.204 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.15 -45.73 83.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.151 -0.477 . . . . 72.340000000000003 110.09 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.22 -40.08 93.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 64.540000000000006 110.95 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.767 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.7 mtpt -52.95 -58.85 5.58 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.931 0.396 . . . . 62.539999999999999 110.438 177.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.6 m -62.36 -36.34 81.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.227 -0.897 . . . . 74.239999999999995 111.414 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.666 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 18.9 t80 -63.16 -48.38 78.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 74.340000000000003 110.461 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.574 ' HA ' ' H ' ' A' ' 25' ' ' ARG . 64.6 t -71.8 -38.69 66.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.421 . . . . 73.430000000000007 110.562 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -55.82 -46.4 78.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.698 -0.683 . . . . 70.409999999999997 111.632 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.19 -48.84 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.306 0.484 . . . . 71.299999999999997 112.306 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -100.32 -15.93 17.85 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.026 0.38 . . . . 75.409999999999997 112.026 -170.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.54 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 6.8 mmt180 65.08 95.28 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.678 0.611 . . . . 74.549999999999997 111.519 -175.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.574 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 50.86 -172.74 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.657 1.183 . . . . 65.299999999999997 112.577 178.265 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.666 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 59.8 m-85 -73.11 143.78 84.08 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.08 -0.509 . . . . 64.25 110.78 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.78 -46.85 12.46 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 122.578 2.186 . . . . 73.019999999999996 111.221 174.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -161.12 38.96 0.15 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.914 -0.773 . . . . 72.0 108.914 174.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.1 m 68.18 -177.28 0.21 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.927 -1.033 . . . . 61.439999999999998 111.893 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 55.03 48.9 18.77 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.501 -0.772 . . . . 72.109999999999999 112.576 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -114.27 110.17 19.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.953 -0.567 . . . . 73.129999999999995 110.908 176.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.23 -145.56 41.21 Favored Glycine 0 C--O 1.235 0.214 0 CA-C-N 115.655 -0.702 . . . . 75.400000000000006 113.495 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -68.38 -34.22 75.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.582 0.706 . . . . 75.519999999999996 109.442 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.429 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 93.5 mt -59.74 -32.87 70.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.858 -1.065 . . . . 74.319999999999993 110.817 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.14 -39.47 97.18 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.019 -0.61 . . . . 75.109999999999999 112.143 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.6 -33.59 47.01 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.179 -0.768 . . . . 75.409999999999997 111.179 178.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.8 ' HZ2' ' HD3' ' A' ' 54' ' ' ARG . 38.0 t90 -58.94 -55.17 38.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.159 -0.52 . . . . 74.209999999999994 110.388 175.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.39 -43.0 99.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.257 -0.883 . . . . 60.240000000000002 111.428 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.31 -41.6 63.09 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.914 0.339 . . . . 75.439999999999998 111.914 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.5 m -73.98 -51.19 16.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.145 0.497 . . . . 73.310000000000002 111.407 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.575 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 30.4 mt-30 -85.71 -12.98 49.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.713 1.005 . . . . 73.010000000000005 113.713 -167.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.42 ' HD2' ' C ' ' A' ' 42' ' ' ARG . 6.2 ppt_? -64.59 -24.5 67.62 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.626 0.727 . . . . 75.140000000000001 109.544 173.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -78.77 -46.36 19.02 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.093 -0.958 . . . . 74.209999999999994 109.824 176.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.575 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 12.2 mmt -60.69 -31.03 70.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.542 -0.754 . . . . 64.400000000000006 110.512 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.427 ' HB2' HD11 ' A' ' 50' ' ' LEU . 23.5 tpt180 -59.11 -45.75 90.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.469 -0.787 . . . . 65.030000000000001 110.623 174.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.441 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 0.4 OUTLIER -71.33 -43.89 66.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.076 -0.511 . . . . 73.549999999999997 109.651 -179.058 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.408 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 45.7 mt-30 -65.63 -14.32 60.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.608 -0.724 . . . . 74.329999999999998 111.791 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.29 26.53 73.34 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.155 -0.545 . . . . 64.439999999999998 112.444 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.8 ptmt -110.35 -4.58 15.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.826 0.346 . . . . 65.239999999999995 111.001 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.562 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 3.9 mt -58.9 140.99 86.22 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.835 -0.62 . . . . 75.409999999999997 109.933 174.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -69.81 131.26 20.79 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.881 2.387 . . . . 64.430000000000007 112.309 176.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.56 -33.97 72.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.399 -0.819 . . . . 73.540000000000006 111.001 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.714 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 19.1 m-20 -51.91 -53.46 40.64 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.483 0.658 . . . . 75.430000000000007 110.028 176.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.8 ' HD3' ' HZ2' ' A' ' 37' ' ' TRP . 33.1 ttm180 -68.14 -48.65 64.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.742 -1.117 . . . . 73.5 111.217 -179.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.448 ' HG2' ' CH2' ' A' ' 65' ' ' TRP . 3.6 tmt_? -50.22 -41.48 50.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.518 -0.765 . . . . 71.040000000000006 110.987 176.588 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.38 -36.14 73.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.559 0.218 . . . . 74.230000000000004 111.119 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 75.6 mt -61.81 -43.14 99.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 53.039999999999999 110.698 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.23 -39.15 86.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.839 -0.619 . . . . 73.420000000000002 111.159 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.94 -28.83 64.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.103 0.478 . . . . 71.120000000000005 110.253 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.465 ' C ' ' HD2' ' A' ' 60' ' ' LYS . 0.4 OUTLIER -66.9 -46.21 75.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.932 -0.576 . . . . 72.400000000000006 110.279 178.922 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.494 HG22 ' HG2' ' A' ' 17' ' ' LYS . 42.6 pt -72.9 -23.07 20.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.551 -0.295 . . . . 73.030000000000001 110.966 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.89 32.4 3.09 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.508 -0.853 . . . . 63.229999999999997 112.933 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -74.79 130.23 39.09 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.031 0.443 . . . . 72.140000000000001 110.29 177.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.451 HG23 ' H ' ' A' ' 66' ' ' SER . 10.6 p -76.13 134.07 29.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.684 -0.689 . . . . 70.510000000000005 110.1 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.448 ' CH2' ' HG2' ' A' ' 55' ' ' ARG . 95.9 m95 -89.75 -12.45 39.31 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.326 -0.397 . . . . 73.150000000000006 111.114 -177.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.451 ' H ' HG23 ' A' ' 64' ' ' VAL . 1.7 p -97.31 81.07 2.96 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.507 0.67 . . . . 74.209999999999994 110.79 176.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.656 HD23 ' HG3' ' A' ' 68' ' ' GLU . 5.3 tt -93.14 119.35 32.25 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.294 -1.002 . . . . 74.340000000000003 108.294 177.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.656 ' HG3' HD23 ' A' ' 67' ' ' LEU . 47.6 mt-10 62.2 -158.22 0.33 Allowed 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.475 0.484 . . . . 72.439999999999998 109.759 -172.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.474 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 71.9 m-70 68.56 137.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.827 0.704 . . . . 72.329999999999998 111.98 175.464 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -151.1 118.1 5.88 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.854 -0.612 . . . . 74.120000000000005 110.57 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -107.87 138.19 44.55 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.302 -0.629 . . . . 71.340000000000003 109.302 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -70.67 111.76 6.39 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.194 0.521 . . . . 64.239999999999995 111.771 -176.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 -110.8 83.31 1.74 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.433 -0.951 . . . . 74.299999999999997 108.433 173.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 47.3 t60 . . . . . 0 C--O 1.247 0.921 0 CA-C-O 118.253 -0.88 . . . . 74.519999999999996 109.7 -174.911 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ttt . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.786 0.327 . . . . 71.010000000000005 110.469 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -73.86 135.51 43.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.297 -0.41 . . . . 73.239999999999995 110.289 177.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -76.35 105.39 7.38 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.15 0.5 . . . . 65.329999999999998 110.054 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -89.5 106.33 18.39 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.357 -0.838 . . . . 64.400000000000006 111.083 -176.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.483 ' HB3' ' H ' ' A' ' 6' ' ' GLN . 10.9 mp 59.25 -155.07 0.36 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.639 -0.709 . . . . 73.150000000000006 111.96 174.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.483 ' H ' ' HB3' ' A' ' 5' ' ' LEU . 10.4 pt20 -144.35 166.06 26.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.329 -0.851 . . . . 74.420000000000002 109.723 -178.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.23 42.2 4.68 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.57 -0.824 . . . . 63.240000000000002 111.358 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -63.3 -21.32 66.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.755 -0.223 . . . . 64.219999999999999 111.188 -177.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.513 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -56.34 -47.73 78.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.755 0.312 . . . . 63.539999999999999 110.296 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.776 ' HE2' ' HA ' ' A' ' 10' ' ' MET . 1.9 tpt -55.37 -43.27 74.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 73.409999999999997 110.321 177.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -66.6 -44.22 82.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.182 -0.917 . . . . 62.299999999999997 110.366 -178.773 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -65.64 -33.04 74.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.236 0.541 . . . . 74.239999999999995 110.787 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.423 ' CE2' ' HD2' ' A' ' 17' ' ' LYS . 91.5 t80 -63.99 -53.48 49.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 73.519999999999996 110.901 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -63.16 -32.27 73.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.273 -0.421 . . . . 74.450000000000003 111.336 -176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 47.7 mt-10 -63.69 -42.4 97.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.821 0.343 . . . . 74.129999999999995 110.979 177.269 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.465 HD22 ' O ' ' A' ' 16' ' ' LEU . 4.4 tt -79.51 -36.19 38.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.898 -0.778 . . . . 64.420000000000002 108.898 -174.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HD2' ' CE2' ' A' ' 13' ' ' TYR . 61.1 tttm -53.75 -44.79 70.28 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.694 -1.139 . . . . 75.409999999999997 110.879 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 58.4 m -82.25 -32.95 29.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.851 -0.613 . . . . 71.010000000000005 111.33 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -64.83 -47.25 78.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.819 0.342 . . . . 71.010000000000005 110.921 -177.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.517 HG11 HD13 ' A' ' 61' ' ' ILE . 8.7 p -65.61 -33.77 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.274 -0.421 . . . . 72.310000000000002 110.511 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.488 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.76 -25.27 62.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.234 0.54 . . . . 61.329999999999998 109.9 179.564 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -93.17 -56.07 3.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.612 -0.722 . . . . 65.409999999999997 111.553 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -90.54 -15.93 29.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.159 -0.473 . . . . 75.510000000000005 111.567 -174.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 9.6 mmm180 58.34 88.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.878 0.736 . . . . 71.5 110.556 -174.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.514 ' HG2' ' N ' ' A' ' 26' ' ' PHE . 37.8 ttt-85 67.24 167.34 0.24 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.698 -1.137 . . . . 72.310000000000002 111.117 -176.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.514 ' N ' ' HG2' ' A' ' 25' ' ' ARG . 52.7 m-85 -78.76 144.93 65.5 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.075 -0.713 . . . . 74.340000000000003 109.075 174.111 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.433 ' HD2' ' OE1' ' A' ' 31' ' ' GLU . 52.2 Cg_exo -53.06 -50.84 12.63 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.288 1.992 . . . . 71.200000000000003 110.884 174.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -172.65 -47.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.542 -0.754 . . . . 73.109999999999999 109.778 173.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 77.9 p -178.39 -162.49 0.06 Allowed 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.219 -0.66 . . . . 72.129999999999995 109.219 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.17 20.15 11.9 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.306 0.574 . . . . 72.530000000000001 111.851 -178.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.433 ' OE1' ' HD2' ' A' ' 27' ' ' PRO . 1.0 OUTLIER -80.61 -172.93 3.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.15 -0.477 . . . . 74.329999999999998 109.893 171.851 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.84 -133.42 0.54 Allowed Glycine 0 CA--C 1.517 0.182 0 C-N-CA 120.697 -0.764 . . . . 75.340000000000003 112.155 177.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -60.96 -29.77 69.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.845 0.355 . . . . 60.020000000000003 110.784 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.459 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 82.4 mt -66.73 -30.94 71.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 72.349999999999994 110.803 176.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.54 -36.66 91.76 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.793 -0.923 . . . . 70.340000000000003 110.793 174.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.21 -38.12 63.26 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.173 -0.771 . . . . 70.030000000000001 111.173 174.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -56.27 -49.24 74.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.907 -0.405 . . . . 75.230000000000004 109.907 174.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.76 -51.26 70.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.622 -0.717 . . . . 72.140000000000001 110.635 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -56.71 -46.85 81.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 74.219999999999999 111.232 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.557 ' O ' ' HG2' ' A' ' 44' ' ' MET . 51.7 m -61.84 -42.58 99.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.222 -0.445 . . . . 72.129999999999995 110.926 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.488 ' HG3' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.78 -27.05 68.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 51.439999999999998 111.744 -175.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -58.77 -36.99 75.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 71.400000000000006 110.217 177.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.426 ' CE ' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -84.07 -34.78 24.13 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.932 -0.307 . . . . 74.549999999999997 110.501 178.131 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.557 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.3 mmt -55.16 -38.94 68.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.269 -0.423 . . . . 74.209999999999994 111.413 -176.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.518 ' HB3' HD11 ' A' ' 50' ' ' LEU . 10.9 ptm180 -72.33 -34.5 68.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.728 0.299 . . . . 74.230000000000004 111.021 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.77 -30.41 59.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.231 -0.655 . . . . 73.319999999999993 109.231 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -77.25 -16.99 58.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.392 -0.822 . . . . 51.329999999999998 110.462 174.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 74.24 24.44 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.965 -0.561 . . . . 74.25 112.642 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -109.13 -3.04 17.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.646 0.26 . . . . 54.020000000000003 111.455 -177.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.848 HD22 ' HD2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -64.65 139.07 97.66 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.644 -0.502 . . . . 62.229999999999997 109.644 176.774 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.848 ' HD2' HD22 ' A' ' 50' ' ' LEU . 2.6 Cg_exo -78.56 124.22 6.28 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.678 2.252 . . . . 74.25 111.753 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -61.06 -31.14 70.8 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.612 -0.722 . . . . 54.439999999999998 109.835 175.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.716 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.2 m-20 -57.56 -52.39 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.495 -0.775 . . . . 65.230000000000004 109.671 174.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.462 ' HG3' ' CH2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -67.42 -31.88 72.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 74.420000000000002 110.119 -178.866 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -60.9 -43.91 97.88 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.307 -0.627 . . . . 72.420000000000002 109.307 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 65.8 tp -72.48 -41.91 65.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.0 -0.546 . . . . 73.519999999999996 110.508 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 79.1 mt -58.03 -43.31 86.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.845 0.355 . . . . 73.439999999999998 110.466 177.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.654 HD13 HD11 ' A' ' 61' ' ' ILE . 21.2 tp -64.77 -44.56 89.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.675 -0.693 . . . . 53.240000000000002 110.403 -178.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -63.19 -38.01 89.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.156 -0.475 . . . . 72.519999999999996 110.322 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -70.84 -36.55 72.95 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.906 -0.588 . . . . 75.319999999999993 111.997 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.654 HD11 HD13 ' A' ' 58' ' ' LEU . 10.7 pt -74.56 -3.66 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.758 0.313 . . . . 61.530000000000001 111.75 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.6 20.06 8.37 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.311 -0.947 . . . . 43.520000000000003 113.497 173.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -87.54 119.72 28.11 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.199 0.523 . . . . 75.239999999999995 110.559 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.473 ' CG1' ' HD2' ' A' ' 25' ' ' ARG . 14.4 p -93.47 128.41 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 CA-C-N 115.473 -0.785 . . . . 54.350000000000001 110.293 177.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.469 ' CH2' HD22 ' A' ' 58' ' ' LEU . 42.0 m95 -80.78 -32.47 35.39 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.646 -0.706 . . . . 72.319999999999993 110.813 -174.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.7 m -73.58 128.68 36.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.85 -0.614 . . . . 65.25 110.843 -178.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.5 tp -88.91 127.77 35.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.019 -0.537 . . . . 74.219999999999999 110.64 -178.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 63.68 15.62 9.09 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.572 0.701 . . . . 71.409999999999997 111.004 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -101.69 50.69 0.84 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.545 0.688 . . . . 74.239999999999995 109.856 177.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -66.23 117.74 8.95 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.009 -0.996 . . . . 70.120000000000005 109.847 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -64.76 125.14 23.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.338 -0.392 . . . . 75.519999999999996 111.141 -173.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -138.2 92.8 2.68 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.929 -0.578 . . . . 73.219999999999999 110.457 174.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -75.98 -18.04 59.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.401 0.619 . . . . 74.439999999999998 109.637 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 117.835 -1.079 . . . . 75.340000000000003 108.514 174.788 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptt? . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 110.281 -0.266 . . . . 74.349999999999994 110.281 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -144.24 147.58 33.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.933 0.397 . . . . 71.340000000000003 110.355 177.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -161.84 98.61 1.09 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.703 -0.851 . . . . 74.209999999999994 108.703 179.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -59.95 149.37 32.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.287 0.565 . . . . 42.229999999999997 111.896 -175.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.0 tp -71.26 137.21 48.41 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.335 -0.848 . . . . 73.329999999999998 109.34 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -73.62 96.0 2.4 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.99 0.424 . . . . 74.129999999999995 110.442 -177.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.81 136.64 22.13 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.525 -1.03 . . . . 62.310000000000002 110.525 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -26.69 65.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 117.05 0.425 . . . . 63.409999999999997 110.623 -174.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 7.3 t-105 -58.63 -51.3 70.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.707 -0.224 . . . . 73.140000000000001 111.199 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.736 ' HA ' ' HE2' ' A' ' 10' ' ' MET . 0.0 OUTLIER -59.84 -31.2 69.52 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.119 0.485 . . . . 52.5 110.381 -179.193 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.68 -48.24 15.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.924 -0.58 . . . . 73.150000000000006 110.058 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -65.28 -32.89 74.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 116.326 -0.397 . . . . 73.329999999999998 111.792 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -65.77 -53.31 42.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.822 0.344 . . . . 73.439999999999998 110.195 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.727 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 65.3 mm-40 -61.21 -31.98 71.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.302 0.572 . . . . 74.25 110.032 176.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.21 -52.24 63.06 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.081 -0.963 . . . . 74.540000000000006 110.095 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.4 tp -61.04 -44.72 96.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.725 -0.671 . . . . 70.209999999999994 111.133 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.727 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.9 mtpt -51.49 -58.42 6.32 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.501 0.667 . . . . 70.140000000000001 109.881 176.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.9 m -61.79 -42.53 99.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.562 -1.199 . . . . 73.140000000000001 111.838 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.47 ' CE2' ' HB3' ' A' ' 26' ' ' PHE . 26.4 t80 -67.18 -46.59 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.63 0.252 . . . . 75.299999999999997 110.799 -176.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 t -66.46 -39.38 83.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.957 -0.297 . . . . 73.400000000000006 110.678 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -60.94 -25.71 66.98 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.007 0.432 . . . . 71.530000000000001 110.203 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -92.77 -58.34 2.38 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.257 -0.429 . . . . 75.109999999999999 112.141 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -100.81 -30.04 11.92 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.207 0.447 . . . . 62.32 112.207 -170.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.3 OUTLIER 64.27 94.65 0.05 Allowed 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 123.846 0.716 . . . . 71.340000000000003 110.461 -168.379 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.2 mmm180 75.61 168.31 0.27 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 114.316 -1.311 . . . . 73.019999999999996 111.185 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.529 ' CZ ' ' HB3' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -132.34 84.61 51.41 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.523 -0.762 . . . . 75.409999999999997 110.067 177.636 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.62 132.45 35.43 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.647 2.232 . . . . 65.340000000000003 111.614 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.44 ' C ' ' HG ' ' A' ' 29' ' ' SER . 75.1 tttt 66.11 27.14 10.57 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.47 0.652 . . . . 74.200000000000003 109.45 178.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.44 ' HG ' ' C ' ' A' ' 28' ' ' LYS . 52.2 p 49.9 68.45 0.74 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 114.924 -1.035 . . . . 64.519999999999996 111.615 -176.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.55 -35.23 75.52 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.46 -0.791 . . . . 63.240000000000002 111.031 178.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HG2' HD21 ' A' ' 34' ' ' LEU . 11.3 tp10 -112.85 121.64 45.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.858 -0.61 . . . . 45.43 109.493 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.63 -34.64 90.43 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.005 -0.617 . . . . 75.150000000000006 112.489 -178.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -60.5 -55.12 37.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.931 0.396 . . . . 71.430000000000007 111.183 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.529 ' HB3' ' CZ ' ' A' ' 26' ' ' PHE . 3.6 mm? -74.37 -26.68 60.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.143 -0.48 . . . . 75.109999999999999 110.709 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.88 97.74 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.61 -0.596 . . . . 73.109999999999999 111.61 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.57 -35.62 75.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.866 -0.683 . . . . 73.230000000000004 111.479 176.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -60.04 -49.81 76.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 74.209999999999994 109.946 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.1 m -70.33 -33.23 71.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.739 -0.664 . . . . 75.340000000000003 111.928 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -53.42 -37.08 62.21 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.799 0.333 . . . . 73.340000000000003 111.309 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 39.7 m -77.95 -44.55 26.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.893 -0.594 . . . . 65.120000000000005 111.369 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -84.84 -19.23 32.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.43 0.9 . . . . 61.409999999999997 113.43 -170.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.65 -26.75 68.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.126 0.489 . . . . 73.030000000000001 109.936 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -70.55 -45.48 65.39 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.526 -0.761 . . . . 65.219999999999999 109.631 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.759 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.5 mmt -65.94 -33.51 75.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.766 -0.652 . . . . 73.310000000000002 110.774 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.662 ' HB2' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -68.43 -47.05 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 73.510000000000005 110.082 178.76 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.41 ' HD2' ' O ' ' A' ' 46' ' ' LYS . 0.3 OUTLIER -63.54 -45.65 89.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.784 -0.643 . . . . 75.099999999999994 109.444 179.819 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.477 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 1.2 tp-100 -67.6 -31.01 70.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 72.540000000000006 110.909 -178.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.84 41.24 4.73 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.206 -0.521 . . . . 75.400000000000006 113.385 174.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.477 ' HE2' ' HB3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -131.96 2.62 4.01 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 117.212 0.506 . . . . 75.349999999999994 111.455 177.654 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.759 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 5.1 mt -54.24 140.0 54.96 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.721 -0.392 . . . . 73.340000000000003 110.434 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.6 140.52 81.7 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 123.262 2.641 . . . . 73.439999999999998 113.002 178.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.468 ' O ' ' HG3' ' A' ' 55' ' ' ARG . 18.1 m120 -64.3 -29.05 70.15 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.057 -0.974 . . . . 74.329999999999998 110.754 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -70.26 -44.27 68.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.066 0.46 . . . . 74.019999999999996 109.828 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' A' ' 54' ' ' ARG . 26.5 mmt180 -59.17 -51.8 68.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 71.25 110.987 177.314 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -66.02 -27.58 68.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.314 -0.403 . . . . 74.329999999999998 110.452 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.32 -44.2 30.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.711 0.291 . . . . 72.409999999999997 110.503 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.1 tp -59.46 -45.89 90.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.977 -0.556 . . . . 71.219999999999999 110.822 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 10.5 mp -66.05 -45.0 82.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.903 -0.589 . . . . 63.409999999999997 110.472 178.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.12 -28.25 69.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.287 0.565 . . . . 65.430000000000007 110.56 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -53.55 19.3 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 115.792 -0.64 . . . . 54.140000000000001 110.959 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.0 pt -68.49 -19.86 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.682 0.277 . . . . 74.329999999999998 111.728 -176.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.98 22.72 4.14 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.591 -0.814 . . . . 65.239999999999995 112.601 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.536 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 45.3 t80 -83.78 103.7 13.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.416 0.627 . . . . 74.519999999999996 109.723 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -82.62 151.74 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 CA-C-N 115.059 -0.973 . . . . 73.25 110.044 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -93.81 25.95 3.37 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.764 0.316 . . . . 74.430000000000007 110.81 -175.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 m -71.18 95.78 1.3 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.443 0.639 . . . . 73.299999999999997 110.66 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.5 pp -144.38 155.2 43.67 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.347 -0.842 . . . . 64.040000000000006 109.144 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -103.71 120.08 40.2 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.21 0.529 . . . . 75.010000000000005 111.178 -176.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -161.44 112.53 1.73 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.35 -0.841 . . . . 63.43 109.47 178.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -60.66 130.29 45.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.18 -0.464 . . . . 73.129999999999995 110.532 -178.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -105.09 123.65 48.18 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.334 -0.617 . . . . 64.420000000000002 109.334 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -117.04 134.95 54.11 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.329 -0.396 . . . . 74.209999999999994 110.7 -173.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -145.15 151.56 38.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.732 0.301 . . . . 73.219999999999999 111.28 176.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.571 -0.728 . . . . 72.530000000000001 109.671 172.226 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.726 ' HB3' HE22 ' A' ' 3' ' ' GLN . 65.1 mtt . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 120.702 0.286 . . . . 72.439999999999998 110.324 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -134.34 104.39 6.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.124 0.488 . . . . 71.040000000000006 110.562 176.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.726 HE22 ' HB3' ' A' ' 1' ' ' MET . 27.5 mp0 -119.47 -23.3 6.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.644 -0.707 . . . . 73.510000000000005 109.658 175.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -118.12 149.0 41.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.779 -0.646 . . . . 51.039999999999999 110.345 -178.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.1 mp 60.13 45.41 11.79 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.913 0.863 . . . . 70.209999999999994 110.116 -178.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -74.56 -169.88 0.93 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.394 -1.275 . . . . 73.030000000000001 110.572 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.0 54.72 3.07 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.999 -0.62 . . . . 54.340000000000003 112.039 176.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -76.08 -33.15 59.52 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.509 -0.552 . . . . 63.409999999999997 109.509 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.56 ' HZ3' ' HZ2' ' A' ' 37' ' ' TRP . 25.6 t-105 -48.79 -50.58 33.54 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.1 -0.955 . . . . 75.310000000000002 112.584 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.885 ' HA ' ' HE1' ' A' ' 10' ' ' MET . 2.4 tpt -53.69 -39.03 64.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.235 0.54 . . . . 74.319999999999993 110.63 -177.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.499 ' HE2' ' HB3' ' A' ' 11' ' ' LYS . 4.5 tmmm? -75.42 -41.93 54.76 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.637 -0.71 . . . . 72.439999999999998 110.199 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -59.0 -38.8 80.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.831 -0.622 . . . . 75.319999999999993 111.092 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -60.93 -48.18 83.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 74.450000000000003 110.371 177.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.647 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 70.6 mm-40 -64.68 -38.97 92.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 71.140000000000001 110.697 178.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -60.28 -45.2 94.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.887 -0.597 . . . . 72.329999999999998 109.692 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.49 HD23 HD12 ' A' ' 58' ' ' LEU . 33.0 tp -58.95 -47.34 85.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 72.310000000000002 110.946 178.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.647 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.3 mtpt -54.99 -55.73 27.65 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.22 0.533 . . . . 71.530000000000001 110.765 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.8 t -55.74 -47.26 77.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.204 -0.907 . . . . 52.100000000000001 111.069 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.562 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 42.2 t80 -65.26 -46.78 79.13 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.274 -0.421 . . . . 74.109999999999999 111.292 -176.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 9.4 p -68.09 -32.56 56.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-N 116.311 -0.404 . . . . 62.43 110.896 -178.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.479 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.6 tmt_? -70.94 -19.08 62.61 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.199 0.524 . . . . 74.030000000000001 110.179 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -85.16 -61.51 1.75 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.939 -0.573 . . . . 65.519999999999996 111.445 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -97.13 -19.0 18.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.767 0.318 . . . . 75.319999999999993 110.777 -176.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.559 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER 60.81 93.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 65.340000000000003 110.546 -168.36 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.485 ' HD2' ' O ' ' A' ' 64' ' ' VAL . 63.0 ttt180 65.21 158.64 0.1 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.445 -1.252 . . . . 73.109999999999999 112.184 -172.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.562 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 11.2 p90 -119.36 143.76 35.08 Favored Pre-proline 0 C--N 1.317 -0.829 0 CA-C-N 114.583 -1.19 . . . . 75.219999999999999 109.387 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 26' ' ' PHE . 3.5 Cg_exo -74.79 -54.44 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.512 2.141 . . . . 65.019999999999996 111.369 178.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -152.29 99.04 2.47 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.382 -0.97 . . . . 74.109999999999999 108.382 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.4 t -105.56 137.0 44.13 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.37 0.605 . . . . 73.310000000000002 112.079 -170.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -130.66 23.31 5.05 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.921 -1.036 . . . . 74.439999999999998 109.489 170.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -84.92 86.33 7.38 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.37 -0.832 . . . . 64.200000000000003 111.11 -176.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 50.06 -108.67 0.52 Allowed Glycine 0 C--N 1.331 0.302 0 CA-C-N 115.548 -0.751 . . . . 70.400000000000006 114.201 173.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -63.44 -44.71 93.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.207 -0.497 . . . . 51.329999999999998 111.055 -174.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.485 HD11 ' HA ' ' A' ' 16' ' ' LEU . 3.1 mm? -75.13 -24.9 58.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.947 -0.569 . . . . 72.140000000000001 110.26 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.49 -36.16 92.77 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.658 -0.701 . . . . 36.399999999999999 112.022 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.42 -36.45 49.66 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.564 -0.827 . . . . 61.030000000000001 111.661 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.56 ' HZ2' ' HZ3' ' A' ' 9' ' ' TRP . 3.7 m95 -58.91 -49.88 76.14 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.032 0.444 . . . . 74.340000000000003 110.596 175.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -61.18 -40.21 93.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.314 -0.857 . . . . 73.310000000000002 111.174 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -69.8 -46.66 65.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.144 0.424 . . . . 65.340000000000003 112.144 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.463 ' O ' ' HG2' ' A' ' 44' ' ' MET . 49.0 m -80.99 -57.52 3.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.429 0.529 . . . . 54.340000000000003 112.429 -172.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.13 -18.46 49.75 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.535 0.939 . . . . 73.349999999999994 113.535 -166.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 42' ' ' ARG . 5.4 tmm_? -65.23 -32.12 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.194 0.521 . . . . 64.310000000000002 109.821 176.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.0 ttmm -76.51 -46.05 28.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.734 -0.666 . . . . 64.340000000000003 110.551 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.528 ' HB3' ' HG3' ' A' ' 49' ' ' LYS . 11.6 mmt -59.92 -28.75 67.87 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.54 -0.755 . . . . 71.340000000000003 111.273 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 ttt180 -64.88 -48.94 72.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.032 0.444 . . . . 73.140000000000001 110.463 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.503 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 3.3 tmmm? -65.76 -34.7 78.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.354 0.597 . . . . 54.350000000000001 109.619 -179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -83.74 1.03 44.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.518 -0.764 . . . . 63.140000000000001 111.704 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 59.25 34.45 80.15 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 116.356 -0.384 . . . . 72.019999999999996 113.232 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.528 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 17.9 ptmt -119.21 1.9 11.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.161 0.505 . . . . 70.420000000000002 110.967 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 mt -61.77 142.22 94.83 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.325 -0.852 . . . . 75.439999999999998 110.113 172.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.494 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 26.0 Cg_exo -64.65 120.69 8.03 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.177 1.918 . . . . 75.010000000000005 111.038 169.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -56.58 -32.86 65.63 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.98 -0.555 . . . . 73.310000000000002 110.42 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -58.31 -41.3 84.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 74.349999999999994 110.57 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.494 ' HG2' ' HB2' ' A' ' 51' ' ' PRO . 18.7 mmt180 -62.1 -50.2 72.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 116.088 -0.506 . . . . 74.439999999999998 110.799 179.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -54.24 -37.81 65.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.778 -0.646 . . . . 72.349999999999994 110.521 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 tt -68.38 -53.1 26.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 75.200000000000003 110.366 178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mp -60.71 -39.39 88.38 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.336 -0.393 . . . . 74.430000000000007 111.592 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.546 HD13 HD11 ' A' ' 61' ' ' ILE . 4.0 mm? -61.66 -40.09 93.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.996 0.427 . . . . 62.420000000000002 110.787 178.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.628 ' HB2' ' HE1' ' A' ' 65' ' ' TRP . 28.8 t70 -66.7 -35.74 80.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.278 -0.419 . . . . 72.329999999999998 110.595 178.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -64.51 -42.55 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 75.140000000000001 111.255 -178.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.546 HD11 HD13 ' A' ' 58' ' ' LEU . 6.8 pt -77.76 -17.05 14.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.741 0.305 . . . . 75.349999999999994 111.682 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 117.4 29.75 2.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.08 -1.057 . . . . 71.530000000000001 113.949 172.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -84.57 106.9 16.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.532 -0.544 . . . . 74.030000000000001 109.532 175.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.485 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 12.9 p -75.14 133.89 30.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.626 -0.715 . . . . 61.450000000000003 110.892 -177.343 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.628 ' HE1' ' HB2' ' A' ' 59' ' ' ASP . 86.8 m95 -101.89 8.85 41.07 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.689 0.28 . . . . 72.299999999999997 111.445 -172.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 41.0 m -57.98 111.33 1.14 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.061 -0.518 . . . . 63.32 111.582 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 62.0 mt -134.3 174.28 10.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.67 -0.695 . . . . 44.299999999999997 109.666 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 63.33 24.81 14.4 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 123.565 0.54 . . . . 73.019999999999996 110.829 174.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -59.6 113.66 2.34 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.479 -0.563 . . . . 74.25 109.479 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -53.24 104.81 0.1 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.495 -0.775 . . . . 73.040000000000006 112.105 -173.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 35.2 m80 -103.24 -82.89 0.49 Allowed 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.83 -0.804 . . . . 74.120000000000005 108.83 171.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -152.21 175.22 12.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.462 -0.79 . . . . 73.239999999999995 109.186 175.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -123.1 160.61 26.05 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.697 -0.853 . . . . 74.349999999999994 108.697 175.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 . . . . . 0 C--O 1.246 0.878 0 C-N-CA 120.669 -0.413 . . . . 64.519999999999996 110.459 178.521 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 120.652 0.263 . . . . 72.530000000000001 111.243 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -125.18 121.05 33.03 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.669 -0.493 . . . . 73.109999999999999 109.669 176.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -73.09 144.2 47.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.834 0.349 . . . . 65.140000000000001 110.797 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 5' ' ' LEU . 31.4 m-80 -88.75 -30.77 18.8 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.275 -0.639 . . . . 72.010000000000005 109.275 177.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.41 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 3.3 mm? 70.63 150.74 0.09 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.943 -1.026 . . . . 71.310000000000002 110.773 -176.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -89.08 99.59 12.55 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.96 0.409 . . . . 75.420000000000002 109.907 179.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.56 84.04 1.2 Allowed Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.906 -0.664 . . . . 73.129999999999995 111.624 -176.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -60.46 -47.01 88.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.826 0.345 . . . . 62.329999999999998 110.621 -177.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.661 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -76.82 -30.36 56.35 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.416 -0.356 . . . . 75.549999999999997 110.844 -176.571 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.445 ' HE2' ' HA ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -61.3 -38.01 85.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 72.030000000000001 109.705 175.775 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 25.1 ttmt -70.14 -49.42 50.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.493 -0.776 . . . . 70.019999999999996 110.097 174.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.463 ' HB2' ' HA ' ' A' ' 9' ' ' TRP . 74.1 m-20 -54.61 -46.4 73.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.19 -0.913 . . . . 75.25 111.511 -178.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.432 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 32.4 t80 -55.65 -48.0 75.71 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.923 -0.581 . . . . 65.349999999999994 112.039 -173.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 11' ' ' LYS . 17.1 pt-20 -68.78 -34.85 76.25 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.96 -0.296 . . . . 75.310000000000002 111.259 -175.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -76.03 -40.91 52.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.033 0.444 . . . . 75.310000000000002 110.121 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.554 HD23 ' CD2' ' A' ' 58' ' ' LEU . 38.2 tp -57.04 -54.17 49.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 74.109999999999999 111.723 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.601 ' HZ2' ' HB3' ' A' ' 17' ' ' LYS . 8.4 mtpm? -51.79 -52.47 48.76 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.426 0.631 . . . . 70.310000000000002 110.556 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.9 m -58.9 -44.62 91.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.506 -1.225 . . . . 71.299999999999997 111.597 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.675 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 7.8 t80 -67.41 -52.42 40.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 74.530000000000001 110.422 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 78.1 t -60.1 -33.91 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.426 . . . . 75.530000000000001 111.621 178.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 21' ' ' ARG . 1.6 tmt_? -61.41 -26.84 68.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.377 -0.374 . . . . 75.329999999999998 111.106 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -108.94 -52.8 2.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.458 -0.337 . . . . 73.310000000000002 111.379 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 88.4 m-85 -90.7 -15.61 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.749 0.278 . . . . 72.510000000000005 111.749 -174.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 63' ' ' PHE . 26.6 mmt180 75.06 -18.46 0.44 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.632 0.773 . . . . 74.420000000000002 112.861 -178.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.507 ' HG3' ' HD3' ' A' ' 27' ' ' PRO . 25.9 ptt180 177.16 174.0 0.45 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.858 -0.423 . . . . 74.400000000000006 109.858 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.675 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 7.7 p90 -138.8 85.6 16.5 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 71.439999999999998 111.363 177.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.507 ' HD3' ' HG3' ' A' ' 25' ' ' ARG . 63.3 Cg_endo -76.19 -15.22 18.33 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.273 1.982 . . . . 71.340000000000003 110.914 173.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.417 ' HB2' ' HE3' ' A' ' 28' ' ' LYS . 37.0 ttmt -145.6 81.31 1.61 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.874 -1.057 . . . . 74.439999999999998 108.649 179.252 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.67 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 32.1 t -95.36 -50.21 5.12 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.084 -0.507 . . . . 71.310000000000002 110.594 -174.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.69 -46.07 0.39 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.121 0.969 . . . . 63.219999999999999 113.604 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.02 162.24 13.32 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.959 0.725 . . . . 65.129999999999995 112.959 -171.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 69.69 -175.9 33.25 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 114.909 -1.041 . . . . 37.829999999999998 112.743 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -69.44 -27.2 65.05 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.112 -0.699 . . . . 72.530000000000001 109.112 176.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.2 mt -63.64 -43.88 95.5 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.441 -0.8 . . . . 71.329999999999998 110.934 177.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.591 ' HA2' ' HB3' ' A' ' 29' ' ' SER . . . -51.82 -42.5 53.24 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 120.838 -0.696 . . . . 37.829999999999998 112.743 176.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.94 -34.49 27.03 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.313 -0.946 . . . . 43.530000000000001 112.261 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.502 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 17.2 t90 -57.17 -49.26 76.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.983 -0.377 . . . . 75.120000000000005 109.983 177.191 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.657 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 42.3 t -58.34 -50.72 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.919 -0.582 . . . . 74.510000000000005 110.63 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -61.62 -37.51 84.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.929 -0.578 . . . . 74.530000000000001 112.257 -176.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 m -82.78 -36.28 25.79 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.902 0.382 . . . . 74.010000000000005 111.405 -177.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.78 ' HG3' HD21 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.58 -18.29 61.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 73.099999999999994 111.581 -176.447 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 38' ' ' CYS . 18.0 mmt180 -52.78 -47.63 67.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.354 0.597 . . . . 71.409999999999997 109.954 173.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 47' ' ' GLN . 1.2 tmmm? -70.29 -42.12 72.46 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.074 -0.967 . . . . 75.430000000000007 110.827 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.645 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.5 mmt -64.11 -35.85 82.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.233 0.54 . . . . 74.200000000000003 110.651 -177.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.576 ' CB ' HD13 ' A' ' 50' ' ' LEU . 2.2 tmm_? -69.42 -49.66 53.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.334 -0.848 . . . . 72.109999999999999 110.17 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.02 -31.58 68.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.157 -0.474 . . . . 65.420000000000002 110.646 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.508 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 4.1 tp-100 -72.74 -22.12 60.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.525 . . . . 70.319999999999993 110.575 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.42 37.52 27.39 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.728 -0.749 . . . . 64.439999999999998 111.98 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 19.2 ptmt -121.06 -1.3 9.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.189 0.519 . . . . 74.319999999999993 110.917 177.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.78 HD21 ' HG3' ' A' ' 41' ' ' GLN . 7.0 mt -68.97 142.58 93.5 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.768 -0.651 . . . . 64.430000000000007 110.09 172.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -73.67 138.32 26.35 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.0 2.466 . . . . 74.319999999999993 111.54 174.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -72.37 -34.8 68.22 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.161 -0.927 . . . . 75.109999999999999 112.457 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.615 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 36.0 m-20 -54.76 -51.86 64.38 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.872 0.367 . . . . 73.349999999999994 110.546 -177.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.661 ' HG3' ' CZ2' ' A' ' 9' ' ' TRP . 2.8 ttp85 -55.58 -38.88 69.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 70.510000000000005 111.301 177.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -59.8 -43.76 94.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.051 0.453 . . . . 72.409999999999997 110.539 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.33 -33.32 63.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.9 -0.591 . . . . 74.549999999999997 110.654 -177.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.2 mt -60.96 -36.45 79.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 73.230000000000004 110.633 177.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.644 HD13 ' CZ2' ' A' ' 65' ' ' TRP . 23.9 mt -63.61 -37.9 89.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 75.120000000000005 110.241 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.27 -25.91 68.26 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.942 -0.572 . . . . 74.420000000000002 111.187 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -36.19 56.06 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.405 -0.362 . . . . 73.409999999999997 110.932 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.4 pt -81.53 -12.22 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.82 0.343 . . . . 73.099999999999994 111.189 177.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.85 18.97 10.02 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.585 -0.817 . . . . 64.230000000000004 113.073 176.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.53 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 42.6 t80 -76.63 107.17 8.73 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.001 -0.74 . . . . 74.120000000000005 109.001 176.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.653 HG22 ' H ' ' A' ' 66' ' ' SER . 13.2 p -78.3 130.96 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 CA-C-N 115.346 -0.843 . . . . 75.349999999999994 111.224 -175.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.644 ' CZ2' HD13 ' A' ' 58' ' ' LEU . 99.8 m95 -93.8 18.42 10.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.611 -0.722 . . . . 74.219999999999999 110.51 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.653 ' H ' HG22 ' A' ' 64' ' ' VAL . 8.4 t 64.1 -165.1 0.24 Allowed 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.206 -0.906 . . . . 63.109999999999999 110.79 -179.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.655 ' HG ' ' H ' ' A' ' 68' ' ' GLU . 21.8 tp 65.89 178.47 0.21 Allowed 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.667 0.604 . . . . 74.530000000000001 110.097 -177.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.655 ' H ' ' HG ' ' A' ' 67' ' ' LEU . 42.7 tt0 -83.12 78.62 9.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.365 0.602 . . . . 74.420000000000002 110.942 -178.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -98.97 90.0 4.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.677 -0.692 . . . . 72.430000000000007 109.572 172.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -75.53 101.64 4.95 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.211 -0.663 . . . . 74.019999999999996 109.211 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -80.8 106.8 13.09 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.847 -0.615 . . . . 63.100000000000001 110.582 -173.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -87.58 132.67 33.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.087 -0.506 . . . . 71.319999999999993 110.215 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.0 p80 -78.86 148.59 32.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.978 0.418 . . . . 74.409999999999997 110.345 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.6 p80 . . . . . 0 C--O 1.247 0.966 0 CA-C-N 115.921 -0.582 . . . . 73.430000000000007 109.512 179.31 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.528 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 8.3 t-105 . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 120.634 0.254 . . . . 75.430000000000007 110.538 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.425 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.7 tpt -56.64 -45.54 81.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.136 -0.483 . . . . 73.219999999999999 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmpt? -68.36 -45.21 73.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 73.340000000000003 110.798 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -69.62 -35.92 75.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.342 -0.39 . . . . 73.129999999999995 111.397 -177.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.44 ' CE1' ' HB3' ' A' ' 57' ' ' LEU . 44.4 t80 -59.29 -50.97 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.779 -0.191 . . . . 75.530000000000001 111.088 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.82 -25.05 64.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.817 0.342 . . . . 73.219999999999999 111.176 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.487 ' OE2' ' HG ' ' A' ' 34' ' ' LEU . 34.8 tt0 -72.18 -41.12 67.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 62.219999999999999 110.107 177.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.538 HD12 HD22 ' A' ' 34' ' ' LEU . 7.1 tt -79.94 -31.51 40.05 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.878 -0.786 . . . . 65.450000000000003 108.878 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.692 ' HA ' HD12 ' A' ' 61' ' ' ILE . 85.4 tttt -55.68 -49.78 72.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.194 . . . . 74.430000000000007 110.371 174.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 m -72.75 -31.08 64.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.44 -0.8 . . . . 72.219999999999999 110.793 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.631 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 29.3 t80 -70.81 -46.99 61.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 71.109999999999999 110.377 -178.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.914 HG22 ' H ' ' A' ' 25' ' ' ARG . 24.2 t -65.2 -34.27 69.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.358 -0.383 . . . . 65.109999999999999 111.688 177.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -58.5 -20.94 50.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.292 0.568 . . . . 72.109999999999999 109.983 175.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -100.48 -47.75 4.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.024 -0.535 . . . . 61.32 111.646 -176.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -111.49 -25.92 9.34 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.378 0.881 . . . . 74.329999999999998 113.378 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.872 ' HA ' HG13 ' A' ' 20' ' ' VAL . 3.0 mpt_? 60.21 92.03 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.908 -0.405 . . . . 70.319999999999993 109.908 -166.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.914 ' H ' HG22 ' A' ' 20' ' ' VAL . 33.3 ttt180 67.59 161.64 0.18 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.75 0.786 . . . . 65.439999999999998 111.548 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.631 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 5.7 p90 . . . . . 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 62.409999999999997 110.513 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.9 t30 . . . . . 0 N--CA 1.464 0.258 0 CA-C-O 120.607 0.242 . . . . 65.239999999999995 111.269 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.538 HD22 HD12 ' A' ' 16' ' ' LEU . 77.7 mt -66.96 -34.26 77.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.847 0.356 . . . . 73.530000000000001 110.141 178.134 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.29 -43.15 97.49 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 53.049999999999997 112.181 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.36 -39.15 57.77 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.839 -0.696 . . . . 63.119999999999997 111.417 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.492 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 6.3 t90 -60.15 -42.53 95.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.91 0.386 . . . . 73.530000000000001 110.444 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.5 t -66.14 -38.83 89.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 72.519999999999996 110.888 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.6 m80 -59.25 -47.86 83.79 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 73.140000000000001 110.64 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.49 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 9.2 m -67.22 -35.1 78.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.204 0.526 . . . . 72.120000000000005 110.571 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.492 ' HB2' ' O ' ' A' ' 37' ' ' TRP . 3.2 tp-100 -65.12 -28.37 69.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.567 -0.742 . . . . 74.310000000000002 111.675 -174.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -54.77 -46.5 74.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 75.310000000000002 110.939 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.558 ' HD3' ' H ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -74.04 -22.53 59.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.062 -0.517 . . . . 73.409999999999997 110.717 -176.924 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.491 ' CB ' ' HG ' ' A' ' 50' ' ' LEU . 25.7 mmt -67.09 -46.25 74.83 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.412 -0.588 . . . . 73.319999999999993 109.412 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.519 ' HB2' HD12 ' A' ' 50' ' ' LEU . 8.1 tmm_? -75.48 -35.68 60.8 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.272 -0.876 . . . . 74.510000000000005 109.819 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.512 ' HB3' ' HA ' ' A' ' 43' ' ' LYS . 1.7 tmtp? -61.0 -47.3 87.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.88 -0.6 . . . . 73.219999999999999 110.706 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -75.4 -31.86 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.142 -0.481 . . . . 74.310000000000002 110.873 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.36 21.65 37.31 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.825 -0.702 . . . . 52.539999999999999 111.85 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.436 ' HD3' ' SD ' ' A' ' 44' ' ' MET . 13.8 ptmt -95.96 -5.1 42.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.095 0.474 . . . . 72.219999999999999 109.763 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' ' 45' ' ' ARG . 1.3 mt -57.43 138.95 81.03 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.047 -0.979 . . . . 63.450000000000003 110.163 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 3.5 Cg_exo -82.46 128.09 5.32 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.115 2.543 . . . . 71.5 111.191 174.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -61.13 -28.54 69.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.817 -0.629 . . . . 53.340000000000003 111.806 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -66.87 -46.11 76.0 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.071 0.463 . . . . 60.130000000000003 109.973 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.528 ' HG2' ' CH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -62.44 -41.57 98.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.005 -0.739 . . . . 73.109999999999999 109.005 176.267 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -62.0 -44.62 96.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.103 -0.953 . . . . 72.239999999999995 110.646 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.64 -41.99 74.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 52.210000000000001 111.724 -177.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.44 ' HB3' ' CE1' ' A' ' 13' ' ' TYR . 5.9 mp -57.87 -43.07 85.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.709 0.262 . . . . 55.43 111.709 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.513 HD22 ' NH2' ' A' ' 54' ' ' ARG . 9.3 mp -71.6 -33.38 68.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 65.150000000000006 111.095 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.92 -38.37 90.73 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.225 0.535 . . . . 51.530000000000001 110.014 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -69.86 -29.99 67.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.173 -0.921 . . . . 75.540000000000006 112.128 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.692 HD12 ' HA ' ' A' ' 17' ' ' LYS . 26.2 pt -84.61 -8.47 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.592 -0.443 . . . . 74.25 110.917 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.06 18.44 9.89 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.701 -0.761 . . . . 65.140000000000001 113.467 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -79.44 104.66 10.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.526 0.679 . . . . 70.120000000000005 109.732 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.447 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 13.0 p . . . . . 0 N--CA 1.442 -0.849 0 CA-C-N 114.945 -1.025 . . . . 74.140000000000001 110.881 -177.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 . . . . . 0 N--CA 1.457 -0.083 0 N-CA-C 109.64 -0.504 . . . . 74.439999999999998 109.64 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.502 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 8.0 mmt -61.16 -40.34 93.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.067 0.46 . . . . 72.530000000000001 109.783 176.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -49.81 75.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.35 -0.841 . . . . 74.239999999999995 110.067 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.411 HD21 ' HB3' ' A' ' 33' ' ' ASN . 10.4 m-80 -57.04 -44.23 82.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.097 -0.501 . . . . 52.119999999999997 110.835 177.286 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.635 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 56.3 t80 -61.36 -52.25 65.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.849 -0.614 . . . . 74.030000000000001 110.578 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.824 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 50.7 mm-40 -61.62 -37.54 84.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.763 0.316 . . . . 62.420000000000002 110.797 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -65.27 -42.34 93.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.272 -0.422 . . . . 64.239999999999995 110.105 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 tp -68.05 -37.31 81.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.913 -0.585 . . . . 62.229999999999997 110.82 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.824 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 59.2 mtpt -55.42 -49.87 71.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.486 0.66 . . . . 73.030000000000001 109.408 172.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 21.3 t -59.72 -40.84 89.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.34 -1.3 . . . . 74.530000000000001 110.739 176.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.27 -37.72 88.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 120.904 0.383 . . . . 73.540000000000006 110.728 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.612 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 21.3 t -71.76 -40.64 69.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.785 0.661 . . . . 71.530000000000001 112.785 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -65.29 -17.0 64.15 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 119.826 -0.75 . . . . 73.129999999999995 110.439 178.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.442 ' HG3' ' HD3' ' A' ' 21' ' ' ARG . 85.6 mttt -97.76 -64.48 1.04 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.957 -0.565 . . . . 71.5 111.654 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -110.62 -5.9 14.96 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 73.329999999999998 111.938 -172.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.612 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 4.3 mpt_? 63.67 12.8 6.85 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.893 0.477 . . . . 53.310000000000002 110.759 -177.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 39.6 ttt180 -170.38 168.78 7.82 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.744 -0.836 . . . . 73.150000000000006 108.744 -171.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.643 ' HE2' ' HB2' ' A' ' 38' ' ' CYS . 8.3 p90 . . . . . 0 C--N 1.319 -0.74 0 CA-C-O 121.505 0.669 . . . . 71.219999999999999 109.89 174.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.411 ' HB3' HD21 ' A' ' 12' ' ' ASN . 77.3 m-20 . . . . . 0 CA--C 1.522 -0.098 0 CA-C-O 120.976 0.417 . . . . 73.209999999999994 110.524 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.628 ' HA ' ' HB2' ' A' ' 37' ' ' TRP . 94.1 mt -71.95 -27.35 62.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.054 -0.521 . . . . 71.239999999999995 110.408 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.6 -43.72 98.9 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 110.604 -0.999 . . . . 74.349999999999994 110.604 173.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.23 -28.91 61.14 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.025 -0.607 . . . . 63.100000000000001 111.606 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.628 ' HB2' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.94 -50.52 70.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.371 0.605 . . . . 64.219999999999999 109.52 174.07 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.643 ' HB2' ' HE2' ' A' ' 26' ' ' PHE . 48.6 t -64.73 -40.48 95.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.177 -0.92 . . . . 73.239999999999995 111.049 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 44.7 m170 -72.02 -54.72 9.04 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.943 0.349 . . . . 74.230000000000004 111.943 -175.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.1 m -63.99 -40.43 96.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.079 0.466 . . . . 75.019999999999996 111.148 -174.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.718 ' HG2' HD21 ' A' ' 50' ' ' LEU . 9.9 mt-30 -84.13 -11.24 56.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.105 -0.498 . . . . 43.539999999999999 111.686 -177.039 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.607 ' HB2' ' O ' ' A' ' 38' ' ' CYS . 6.1 tpt180 -62.45 -36.25 81.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.932 0.873 . . . . 74.319999999999993 109.291 174.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.421 ' HE3' ' NE2' ' A' ' 47' ' ' GLN . 71.6 tttt -73.63 -54.36 8.33 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.405 -1.27 . . . . 75.25 111.134 178.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.484 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.4 mmt -57.62 -38.42 74.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.996 -0.547 . . . . 71.230000000000004 112.021 -178.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.456 ' HB3' HD12 ' A' ' 50' ' ' LEU . 9.5 ptm180 -65.24 -32.39 74.03 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.995 0.426 . . . . 75.329999999999998 110.899 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.16 -43.8 50.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.42 0.629 . . . . 64.25 109.561 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.421 ' NE2' ' HE3' ' A' ' 43' ' ' LYS . 93.3 mt-30 -72.58 -30.13 64.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.09 -0.959 . . . . 72.219999999999999 111.831 -177.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.87 30.41 17.88 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.523 -1.031 . . . . 74.340000000000003 110.523 -171.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.886 ' HE2' ' HA ' ' A' ' 49' ' ' LYS . 10.2 mmpt? -102.35 -8.44 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 115.3 -0.45 . . . . 74.340000000000003 110.257 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 41' ' ' GLN . 2.9 mt -63.33 139.02 97.51 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.603 -0.726 . . . . 74.510000000000005 109.51 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.715 ' HD2' HD23 ' A' ' 50' ' ' LEU . 56.5 Cg_endo -75.71 145.19 28.82 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.105 1.87 . . . . 73.540000000000006 112.337 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.1 -30.4 70.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.347 -0.842 . . . . 52.539999999999999 110.264 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.694 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.7 m-20 -59.73 -51.01 71.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.914 -0.584 . . . . 71.040000000000006 110.828 176.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.469 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 2.3 tmt_? -57.31 -38.23 73.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.096 0.474 . . . . 64.310000000000002 110.018 -179.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttt180 -64.6 -49.58 70.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.797 -0.638 . . . . 71.439999999999998 110.475 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 tt -64.87 -40.02 94.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.352 -0.84 . . . . 74.409999999999997 110.13 -176.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.694 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.4 mt -55.12 -39.94 69.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 73.310000000000002 111.042 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 87.3 mt -61.85 -45.48 93.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.036 -0.529 . . . . 71.230000000000004 110.665 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -65.36 -33.42 75.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.972 0.415 . . . . 63.310000000000002 110.879 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.71 -36.14 75.65 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.929 -0.578 . . . . 74.340000000000003 111.16 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.696 HG21 ' HG2' ' A' ' 17' ' ' LYS . 19.5 pt -85.68 -26.57 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.594 -0.275 . . . . 62.439999999999998 111.524 176.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 109.97 33.85 2.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.548 -0.834 . . . . 60.5 112.797 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.607 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 77.8 t80 -72.31 135.21 45.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.877 0.37 . . . . 64.510000000000005 110.328 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 N--CA 1.445 -0.718 0 CA-C-O 121.55 0.69 . . . . 71.120000000000005 110.554 -179.046 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.474 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.145 0 N-CA-C 109.023 -0.732 . . . . 65.219999999999999 109.023 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 47.9 ttm -55.32 -33.81 63.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 52.420000000000002 110.871 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.36 -53.98 20.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.56 -0.745 . . . . 72.109999999999999 110.471 -177.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -77.11 -20.06 56.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.75 0.309 . . . . 75.239999999999995 111.077 -176.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 17' ' ' LYS . 74.8 t80 -51.38 -43.78 61.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 74.219999999999999 110.137 173.584 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -62.91 -36.4 83.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.891 -0.595 . . . . 74.319999999999993 111.304 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.3 -44.1 92.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 73.030000000000001 111.237 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.442 HD23 ' O ' ' A' ' 16' ' ' LEU . 3.4 tt -79.14 -32.58 44.43 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.591 -0.892 . . . . 72.140000000000001 108.591 -176.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 13' ' ' TYR . 84.5 tttt -51.38 -51.91 50.49 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.729 -1.123 . . . . 73.299999999999997 110.511 174.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 25.6 t -76.58 -34.62 58.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.495 -0.775 . . . . 74.540000000000006 110.685 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.55 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 3.1 t80 -66.0 -45.35 81.89 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.869 0.366 . . . . 73.319999999999993 110.861 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.551 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 7.7 p -65.75 -34.4 70.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.373 -0.376 . . . . 73.329999999999998 111.588 -176.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.457 ' HD2' ' C ' ' A' ' 21' ' ' ARG . 5.6 ppt_? -79.43 -16.39 56.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.352 0.596 . . . . 73.120000000000005 110.325 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.8 tptm -89.31 -53.72 4.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.694 -0.685 . . . . 75.219999999999999 111.137 -174.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -115.57 -10.36 11.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.8 -0.182 . . . . 75.219999999999999 111.364 -178.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.551 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 64.16 93.45 0.06 Allowed 'General case' 0 CA--C 1.518 -0.286 0 O-C-N 123.667 0.604 . . . . 75.340000000000003 110.126 -170.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.665 ' HD3' ' O ' ' A' ' 64' ' ' VAL . 57.0 mtm180 65.92 -174.69 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 114.569 -1.196 . . . . 74.299999999999997 110.551 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.55 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 2.9 p90 . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.785 -0.643 . . . . 74.239999999999995 109.819 171.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 37' ' ' TRP . 6.9 p30 . . . . . 0 CA--C 1.53 0.174 0 N-CA-C 111.461 0.171 . . . . 61.310000000000002 111.461 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.43 -28.31 59.31 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.869 0.366 . . . . 53.32 110.807 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.16 -45.59 96.24 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.689 -0.767 . . . . 74.239999999999995 111.53 178.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.03 -29.31 59.03 Favored Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 111.143 -0.783 . . . . 65.310000000000002 111.143 176.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.466 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 2.7 t90 -58.16 -55.79 30.42 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.085 0.554 . . . . 73.219999999999999 110.508 178.053 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.32 -46.76 87.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 73.040000000000006 110.787 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.444 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.3 m80 -57.43 -46.21 83.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.122 -0.49 . . . . 75.5 112.013 -178.091 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.3 t -70.65 -35.08 72.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.018 0.437 . . . . 62.520000000000003 110.848 -175.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.598 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 3.0 mt-30 -86.42 -21.39 27.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.23 0.826 . . . . 70.219999999999999 113.23 -172.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -69.17 -22.75 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.095 -0.642 . . . . 75.120000000000005 109.494 174.991 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 2.8 tmmm? -73.45 -30.41 63.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.359 -0.837 . . . . 70.349999999999994 109.952 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.598 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 13.4 mmt -67.62 -33.83 75.77 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.744 0.307 . . . . 74.299999999999997 110.39 174.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.739 ' HB2' HD12 ' A' ' 50' ' ' LEU . 17.4 tpt180 -72.98 -39.06 66.41 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.519 -0.472 . . . . 75.099999999999994 110.389 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -56.93 -44.76 82.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.372 0.606 . . . . 72.209999999999994 109.602 173.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.496 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 58.9 mt-30 -64.83 -29.58 70.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.191 -0.913 . . . . 71.400000000000006 110.996 174.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.99 28.65 44.86 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.969 -0.634 . . . . 75.129999999999995 111.582 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.496 ' HG2' ' HB2' ' A' ' 47' ' ' GLN . 18.3 ptmt -113.16 0.42 14.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 73.239999999999995 111.025 -176.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.739 HD12 ' HB2' ' A' ' 45' ' ' ARG . 1.8 mt -58.81 139.94 86.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.81 -0.632 . . . . 75.409999999999997 110.207 179.467 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 4.3 Cg_exo -82.23 158.63 17.56 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 122.672 2.248 . . . . 73.530000000000001 111.486 173.462 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -71.08 -31.8 68.28 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.07 -0.968 . . . . 73.510000000000005 110.643 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.6 -51.24 50.32 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.917 -0.583 . . . . 74.140000000000001 112.231 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.582 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 47.5 ttt-85 -60.92 -50.52 73.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.047 0.451 . . . . 72.420000000000002 110.451 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.408 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -64.89 -26.83 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.764 -0.653 . . . . 61.420000000000002 110.964 -178.57 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -77.11 -51.73 10.52 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.212 -0.449 . . . . 74.530000000000001 110.726 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.2 mp -58.99 -43.23 91.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.447 -0.342 . . . . 53.350000000000001 111.043 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.631 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 71.2 mt -62.24 -40.77 97.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 75.340000000000003 110.31 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.408 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 15.6 t70 -57.68 -41.18 81.09 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.861 -0.609 . . . . 45.219999999999999 111.105 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.439 ' N ' ' HD2' ' A' ' 60' ' ' LYS . 1.6 mptp? -77.31 -28.93 53.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.756 -0.656 . . . . 74.319999999999993 112.589 -173.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 16.1 pt -82.85 -14.34 11.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.269 -0.572 . . . . 71.140000000000001 110.89 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 112.16 23.52 5.48 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.37 -0.919 . . . . 33.229999999999997 113.532 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.631 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 32.6 t80 -88.58 103.8 16.24 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.344 0.592 . . . . 53.509999999999998 109.794 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.665 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 14.4 p . . . . . 0 N--CA 1.443 -0.791 0 CA-C-N 115.205 -0.907 . . . . 72.030000000000001 110.775 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.468 ' HZ2' HD13 ' A' ' 57' ' ' LEU . 6.2 t-105 . . . . . 0 C--O 1.228 -0.029 0 CA-C-O 120.908 0.385 . . . . 72.329999999999998 110.36 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 78.1 mmm -61.6 -29.88 70.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 74.049999999999997 110.42 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -78.26 -49.6 13.41 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.522 -0.763 . . . . 71.030000000000001 109.788 176.587 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -52.74 -35.67 56.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.194 0.998 . . . . 74.200000000000003 111.164 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -52.87 -39.41 62.6 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.979 -1.009 . . . . 73.510000000000005 110.833 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -63.44 -43.24 97.97 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.139 0.274 . . . . 75.099999999999994 111.521 -177.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.406 ' HB3' HD11 ' A' ' 34' ' ' LEU . 3.3 mp0 -63.52 -40.45 97.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.002 0.43 . . . . 73.519999999999996 110.771 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.9 tp -78.65 -45.36 21.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.439 0.638 . . . . 74.400000000000006 109.321 -173.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -51.05 -51.02 57.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.442 -1.254 . . . . 63.520000000000003 111.353 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.0 m -70.41 -38.28 74.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.251 -0.886 . . . . 71.129999999999995 111.029 -176.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.413 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 17.2 t80 -76.36 -44.98 34.05 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.446 -0.502 . . . . 72.109999999999999 111.092 -173.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.682 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 54.5 t -61.4 -33.91 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.144 -0.48 . . . . 73.109999999999999 110.993 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.464 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -58.26 -29.26 65.65 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.112 0.482 . . . . 55.32 110.767 176.013 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -91.26 -61.58 1.63 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.225 -0.443 . . . . 62.43 111.703 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -101.59 -6.7 23.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.35 0.5 . . . . 64.230000000000004 112.35 -174.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.682 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 28.4 mmt180 68.43 -0.59 2.17 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.173 0.589 . . . . 71.109999999999999 111.684 -178.015 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 80.9 mtt180 -168.71 172.01 8.25 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.326 1.05 . . . . 72.040000000000006 108.722 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.485 ' HZ ' ' HB2' ' A' ' 38' ' ' CYS . 10.2 p90 . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 121.345 0.593 . . . . 71.450000000000003 110.332 172.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.0 m120 . . . . . 0 N--CA 1.461 0.098 0 CA-C-O 120.729 0.3 . . . . 72.450000000000003 111.792 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.406 HD11 ' HB3' ' A' ' 15' ' ' GLU . 83.0 mt -71.9 -38.76 69.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.415 -0.357 . . . . 74.230000000000004 111.756 -173.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.95 -43.74 96.6 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.923 -0.656 . . . . 43.0 111.889 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.19 -34.77 54.49 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.382 -0.687 . . . . 64.200000000000003 111.382 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.506 ' HH2' HD21 ' A' ' 58' ' ' LEU . 9.0 t90 -54.34 -52.22 62.26 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.31 0.576 . . . . 72.430000000000007 109.831 174.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.485 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.1 t -62.49 -46.33 88.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.937 -1.029 . . . . 55.530000000000001 111.131 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -56.77 -45.56 82.04 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.832 0.308 . . . . 73.230000000000004 111.832 -177.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.456 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 91.6 m -65.07 -48.17 74.73 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.314 -0.403 . . . . 64.010000000000005 111.691 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -84.7 -24.41 28.95 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.217 0.821 . . . . 71.439999999999998 113.217 -170.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' C ' ' HD2' ' A' ' 42' ' ' ARG . 1.4 tmm_? -62.88 -33.34 75.09 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.731 -0.84 . . . . 73.040000000000006 108.731 173.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 40' ' ' THR . 62.3 tttt -61.88 -50.52 71.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.248 -0.887 . . . . 74.530000000000001 110.575 175.197 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.664 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.6 mmt -61.39 -34.0 74.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 75.319999999999993 110.848 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.02 -48.11 81.75 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.458 -0.571 . . . . 61.310000000000002 109.458 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.9 tttp -66.65 -49.32 66.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.287 -0.869 . . . . 74.129999999999995 111.054 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -60.79 -32.08 71.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.943 -0.571 . . . . 73.349999999999994 111.757 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.32 41.01 5.91 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.581 -0.819 . . . . 60.350000000000001 111.95 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -133.31 11.47 4.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.014 0.435 . . . . 75.010000000000005 111.459 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.664 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 4.1 mt -64.79 141.24 98.28 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-N 115.88 -0.6 . . . . 63.43 109.808 175.379 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.69 134.84 31.42 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.72 2.28 . . . . 74.140000000000001 111.755 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -60.19 -39.48 86.7 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.378 -0.828 . . . . 72.319999999999993 109.942 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.637 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.8 m-20 -56.61 -43.72 80.45 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.729 -0.669 . . . . 65.430000000000007 110.44 176.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -62.5 -49.47 75.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.563 -0.744 . . . . 42.340000000000003 110.265 -178.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -51.73 -44.37 63.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.403 -0.817 . . . . 74.329999999999998 110.309 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.604 ' HA ' ' OD2' ' A' ' 59' ' ' ASP . 7.0 mp -64.7 -41.71 95.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 72.109999999999999 111.481 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.1 mt -53.19 -39.38 63.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.937 0.399 . . . . 65.540000000000006 110.648 178.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 4.3 mm? -68.48 -49.51 59.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.68 -0.691 . . . . 75.319999999999993 111.411 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.604 ' OD2' ' HA ' ' A' ' 56' ' ' LEU . 1.9 p30 -73.27 -20.56 60.8 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.154 -0.619 . . . . 73.109999999999999 111.03 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -65.86 -41.4 91.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.784 0.326 . . . . 74.450000000000003 111.407 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -84.61 -2.74 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 74.230000000000004 110.871 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.521 ' O ' ' HD2' ' A' ' 24' ' ' ARG . . . 97.23 22.89 15.79 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 120.76 -0.734 . . . . 34.210000000000001 113.609 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.593 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 72.1 t80 -75.05 133.31 41.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.473 0.654 . . . . 63.009999999999998 110.164 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 73.6 t . . . . . 0 C--N 1.316 -0.869 0 CA-C-N 115.058 -0.974 . . . . 72.420000000000002 110.715 -177.873 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.733 ' HH2' HH21 ' A' ' 54' ' ' ARG . 5.8 t-105 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.847 0.356 . . . . 72.329999999999998 110.429 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.503 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.1 tpt -56.88 -37.57 71.54 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.229 0.538 . . . . 61.32 110.29 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.444 ' C ' ' HD2' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.63 -46.91 51.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.64 -0.709 . . . . 72.519999999999996 110.594 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -56.82 -35.48 68.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.961 0.41 . . . . 65.239999999999995 110.767 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -59.94 -50.71 72.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.002 -0.544 . . . . 72.319999999999993 109.896 176.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 6.4 mm-40 -63.87 -39.04 93.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.083 -0.508 . . . . 73.329999999999998 110.717 176.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -61.82 -37.05 82.96 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.611 . . . . 74.140000000000001 110.282 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.764 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.0 tt -76.65 -43.21 39.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 65.349999999999994 111.016 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 58.2 mtpt -55.99 -57.02 13.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.329 0.585 . . . . 72.430000000000007 110.552 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.522 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 36.9 p -57.99 -30.2 65.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.853 -1.067 . . . . 74.25 111.322 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 34.8 t80 -70.62 -49.63 45.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.346 . . . . 72.510000000000005 110.305 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.2 t -59.63 -37.93 73.11 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 N-CA-C 111.777 0.288 . . . . 74.230000000000004 111.777 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.407 ' HG2' ' HA ' ' A' ' 18' ' ' SER . 19.7 ptt180 -74.71 -18.88 60.44 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.374 -0.53 . . . . 65.430000000000007 110.586 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 18' ' ' SER . 53.5 tttm -94.87 -46.38 6.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 64.25 111.335 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -118.31 -19.69 8.83 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.148 -0.221 . . . . 73.25 111.33 -176.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.626 HH12 ' HA3' ' A' ' 62' ' ' GLY . 11.3 mmm180 65.85 98.5 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 O-C-N 123.778 0.674 . . . . 73.040000000000006 111.563 -178.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.414 ' HG3' HG12 ' A' ' 64' ' ' VAL . 0.6 OUTLIER 71.29 163.4 0.26 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.936 -1.029 . . . . 75.25 110.962 179.074 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.572 ' HE2' ' HB3' ' A' ' 38' ' ' CYS . 8.4 p90 . . . . . 0 C--N 1.32 -0.687 0 CA-C-O 121.518 0.675 . . . . 72.209999999999994 110.81 175.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 . . . . . 0 CA--C 1.52 -0.189 0 CA-C-O 121.296 0.57 . . . . 72.230000000000004 109.717 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.764 HD11 ' HA ' ' A' ' 16' ' ' LEU . 57.2 mt -64.13 -33.68 76.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.213 -0.903 . . . . 72.430000000000007 111.155 -178.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -51.65 -43.22 53.29 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.934 -0.651 . . . . 72.329999999999998 111.985 172.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.04 -31.45 34.94 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.849 -0.691 . . . . 75.319999999999993 111.697 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.411 ' HB2' ' HA ' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -56.87 -50.54 72.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.901 0.382 . . . . 64.150000000000006 110.719 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.572 ' HB3' ' HE2' ' A' ' 26' ' ' PHE . 30.0 p -65.05 -30.34 71.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 72.519999999999996 111.118 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -63.61 -47.25 82.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.788 0.328 . . . . 73.030000000000001 111.08 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.447 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 23.5 m -77.62 -20.86 53.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.205 0.526 . . . . 52.32 110.945 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.524 ' HG3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -77.64 -25.82 50.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.553 -0.294 . . . . 70.239999999999995 110.972 179.667 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 12.3 mmt180 -54.1 -47.1 72.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.226 0.536 . . . . 71.209999999999994 109.599 172.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 40' ' ' THR . 28.1 tttp -51.54 -62.56 1.55 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.624 -1.171 . . . . 63.310000000000002 111.181 175.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.431 ' HE2' HG22 ' A' ' 40' ' ' THR . 11.8 mmt -55.81 -46.22 78.11 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.058 -0.519 . . . . 73.209999999999994 112.229 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.543 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -65.13 -39.33 92.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.342 0.497 . . . . 74.120000000000005 112.342 -170.681 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.445 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 62.9 pttt -80.21 -19.19 47.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 75.310000000000002 110.4 -179.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -89.77 -14.86 33.64 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.445 -0.798 . . . . 75.329999999999998 110.876 178.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.92 27.49 68.71 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.833 -0.622 . . . . 42.009999999999998 112.297 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -100.53 -12.8 18.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.76 0.314 . . . . 73.409999999999997 110.748 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 1.021 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.5 OUTLIER -60.03 139.12 91.0 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.86 -0.609 . . . . 70.230000000000004 109.661 177.851 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 1.021 ' HD2' HD23 ' A' ' 50' ' ' LEU . 39.9 Cg_endo -73.28 127.92 12.39 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.303 2.002 . . . . 74.310000000000002 112.671 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.413 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 32.4 t-20 -59.39 -37.39 77.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.001 -0.999 . . . . 71.439999999999998 109.876 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -56.1 -48.58 75.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.569 -0.741 . . . . 50.420000000000002 111.306 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.733 HH21 ' HH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -71.14 -26.24 62.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.266 -0.424 . . . . 73.219999999999999 110.118 -175.187 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.413 ' HB3' ' O ' ' A' ' 52' ' ' ASN . 25.4 ttm-85 -61.84 -39.97 93.67 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.155 0.502 . . . . 73.420000000000002 109.792 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 mp -70.2 -32.14 69.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.595 -0.729 . . . . 63.030000000000001 110.76 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.72 -39.4 94.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.151 0.501 . . . . 75.439999999999998 109.8 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.745 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 82.3 mt -71.04 -33.43 70.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.842 -0.617 . . . . 44.530000000000001 110.17 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.49 -32.65 74.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 74.430000000000007 110.887 177.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -62.0 -40.44 95.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 54.130000000000003 111.608 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 11.2 pt -87.99 -12.38 10.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.855 0.359 . . . . 73.319999999999993 111.362 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.626 ' HA3' HH12 ' A' ' 24' ' ' ARG . . . 102.79 25.86 7.41 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.69 -0.767 . . . . 74.099999999999994 113.623 174.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.745 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 56.2 t80 -76.33 104.96 7.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.484 -0.561 . . . . 74.200000000000003 109.484 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.414 HG12 ' HG3' ' A' ' 25' ' ' ARG . 6.6 p . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 74.049999999999997 111.133 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 108.823 -0.806 . . . . 73.420000000000002 108.823 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.5 ttm -58.09 -40.87 82.19 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.219 -0.446 . . . . 62.340000000000003 110.017 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -58.05 -55.84 29.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.391 -0.822 . . . . 61.130000000000003 110.098 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.99 -39.42 81.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.449 -0.796 . . . . 62.310000000000002 111.171 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -59.4 -47.96 83.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 75.310000000000002 110.824 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.31 -40.91 96.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.849 0.357 . . . . 61.219999999999999 111.119 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.691 ' HB3' HD21 ' A' ' 34' ' ' LEU . 16.5 mm-40 -62.67 -32.57 73.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.22 -0.446 . . . . 63.439999999999998 110.969 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.844 HD13 HD11 ' A' ' 58' ' ' LEU . 1.2 tt -84.79 -34.45 22.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.822 -0.807 . . . . 71.319999999999993 108.822 -178.095 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -55.38 -37.12 67.14 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.051 -0.977 . . . . 70.430000000000007 109.491 172.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -82.55 -27.65 31.49 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 73.129999999999995 110.951 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -75.27 -36.17 61.26 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.837 0.351 . . . . 75.5 110.843 -177.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.483 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 62.9 t -57.96 -38.02 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 73.209999999999994 110.276 173.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.532 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.5 tmt_? -76.03 -24.86 55.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.233 0.539 . . . . 74.209999999999994 109.944 176.159 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.436 ' HG3' ' CD2' ' A' ' 23' ' ' TYR . 24.5 tptm -71.66 -60.54 2.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.656 . . . . 75.5 111.482 -176.535 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.436 ' CD2' ' HG3' ' A' ' 22' ' ' LYS . 58.2 m-85 -126.15 3.96 7.15 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 63.219999999999999 112.196 -177.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.483 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 26.7 mmt-85 61.39 93.95 0.04 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.855 0.36 . . . . 74.209999999999994 110.802 -173.262 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.931 ' HG2' ' H ' ' A' ' 26' ' ' PHE . 40.2 ttt180 58.73 -169.57 0.13 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.618 -0.719 . . . . 74.349999999999994 109.927 -174.034 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.931 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.442 -0.843 0 CA-C-O 120.746 0.307 . . . . 71.329999999999998 110.253 170.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.835 0.35 . . . . 74.140000000000001 111.233 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.691 HD21 ' HB3' ' A' ' 15' ' ' GLU . 2.7 mm? -64.25 -28.55 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 74.450000000000003 111.062 -176.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -55.87 -44.77 87.36 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 74.420000000000002 112.062 174.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -83.08 -28.0 38.76 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.682 -0.771 . . . . 65.5 112.177 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.438 ' CH2' ' HG2' ' A' ' 41' ' ' GLN . 16.5 t90 -57.87 -50.55 72.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.707 -0.246 . . . . 72.430000000000007 111.02 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 26.8 p -59.85 -40.97 90.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.228 -0.442 . . . . 61.409999999999997 110.756 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -59.02 -46.1 89.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 73.530000000000001 110.73 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -76.16 -40.17 53.23 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.771 -0.65 . . . . 73.209999999999994 111.259 -175.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.438 ' HG2' ' CH2' ' A' ' 37' ' ' TRP . 1.5 mp0 -78.7 -22.56 46.5 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.882 0.327 . . . . 53.240000000000002 111.882 -175.156 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.426 ' HD3' ' C ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -65.64 -33.22 75.39 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.702 -0.481 . . . . 73.0 109.702 176.379 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -58.42 -52.49 65.4 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.04 -0.527 . . . . 72.430000000000007 109.971 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.735 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 9.6 mmt -58.56 -33.35 69.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.335 -0.848 . . . . 74.040000000000006 110.657 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.95 -39.94 75.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.689 -0.687 . . . . 61.130000000000003 110.197 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -72.24 -48.5 42.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.876 -0.602 . . . . 55.119999999999997 110.698 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -63.56 -22.22 66.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.658 -0.701 . . . . 73.099999999999994 111.747 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 76.25 29.92 57.75 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.682 -0.771 . . . . 64.239999999999995 111.479 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -113.75 3.15 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.8 0.333 . . . . 63.32 110.45 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.735 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 2.6 mt -59.65 138.26 89.78 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.689 -0.687 . . . . 63.409999999999997 109.376 175.052 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.505 ' HG2' ' HB2' ' A' ' 54' ' ' ARG . 81.5 Cg_endo -84.62 149.45 11.35 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.218 1.945 . . . . 64.439999999999998 112.333 176.164 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -70.98 -27.44 63.71 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.15 -0.932 . . . . 75.430000000000007 109.976 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.55 -51.7 68.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 40.299999999999997 110.433 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.505 ' HB2' ' HG2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -63.87 -38.54 91.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 65.010000000000005 110.309 179.513 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -61.67 -45.94 91.87 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.038 -0.528 . . . . 61.100000000000001 110.563 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.3 tp -68.71 -42.27 77.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.387 -0.37 . . . . 65.439999999999998 111.55 -177.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.36 -39.46 79.61 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.737 0.303 . . . . 72.439999999999998 110.86 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.844 HD11 HD13 ' A' ' 16' ' ' LEU . 4.3 mm? -71.14 -43.31 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.24 0.543 . . . . 74.450000000000003 110.765 177.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.92 -28.55 69.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 64.340000000000003 110.231 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -74.61 -30.13 61.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 53.130000000000003 112.373 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.771 HD11 HD13 ' A' ' 58' ' ' LEU . 27.2 pt -87.72 1.47 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 120.519 -0.472 . . . . 61.210000000000001 111.101 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.88 16.31 31.19 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.449 -0.881 . . . . 73.319999999999993 113.021 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.55 105.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.062 0.458 . . . . 72.25 109.799 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.52 HG12 ' HB2' ' A' ' 25' ' ' ARG . 7.4 p . . . . . 0 N--CA 1.446 -0.645 0 CA-C-N 115.419 -0.81 . . . . 54.240000000000002 110.413 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.431 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 19.1 t-105 . . . . . 0 C--O 1.225 -0.209 0 N-CA-C 109.88 -0.415 . . . . 74.409999999999997 109.88 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.4 ttm -61.6 -37.73 84.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.146 -0.479 . . . . 72.239999999999995 110.482 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -56.93 -51.55 68.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.37 -0.832 . . . . 71.120000000000005 111.532 -178.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -78.18 -27.22 47.93 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.774 -0.37 . . . . 70.420000000000002 110.792 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -58.58 -46.05 87.78 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.492 -0.322 . . . . 74.329999999999998 111.351 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -65.16 -35.18 80.28 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 45.32 111.233 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.73 -33.66 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.278 0.561 . . . . 72.329999999999998 109.932 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 58' ' ' LEU . 47.0 tp -80.89 -39.93 25.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.347 -0.842 . . . . 72.400000000000006 109.537 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -55.6 -43.61 76.2 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.719 -1.128 . . . . 74.219999999999999 110.19 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.4 m -72.04 -34.93 69.17 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.492 -0.776 . . . . 72.040000000000006 110.425 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.658 ' HA ' ' HD2' ' A' ' 22' ' ' LYS . 32.0 t80 -71.82 -41.34 68.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 72.519999999999996 110.964 -175.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.68 -39.29 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.446 -0.343 . . . . 72.299999999999997 110.137 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -24.69 67.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.417 0.627 . . . . 73.400000000000006 109.847 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.658 ' HD2' ' HA ' ' A' ' 19' ' ' PHE . 42.0 mttm -77.53 -68.97 0.57 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.561 -0.745 . . . . 75.530000000000001 111.599 -178.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 45.8 m-85 -120.86 -15.24 8.37 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.027 -0.269 . . . . 75.530000000000001 111.518 -171.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 23' ' ' TYR . 1.1 mpp_? 70.72 111.53 0.06 Allowed 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 123.947 0.78 . . . . 73.430000000000007 110.789 -171.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.514 ' HG2' ' H ' ' A' ' 26' ' ' PHE . 22.0 ttt180 71.55 -178.25 0.21 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.724 -1.126 . . . . 75.430000000000007 110.23 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.514 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 3.6 m-85 . . . . . 0 C--N 1.33 -0.24 0 N-CA-C 111.541 0.2 . . . . 64.109999999999999 111.541 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 . . . . . 0 CA--C 1.519 -0.24 0 N-CA-C 108.904 -0.776 . . . . 65.340000000000003 108.904 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.548 HD21 ' HB2' ' A' ' 16' ' ' LEU . 88.9 mt -66.06 -30.23 70.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.952 -1.022 . . . . 64.0 111.248 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -53.73 -40.93 64.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.058 -0.591 . . . . 64.510000000000005 112.151 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.47 -32.33 31.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.778 -0.725 . . . . 61.439999999999998 111.626 176.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.667 ' CZ2' ' HD3' ' A' ' 54' ' ' ARG . 26.2 t90 -54.15 -55.27 29.36 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.178 0.591 . . . . 71.310000000000002 111.126 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 7.1 p -67.12 -30.79 70.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.788 -0.642 . . . . 55.149999999999999 111.624 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -67.35 -36.47 81.47 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.763 0.282 . . . . 64.519999999999996 111.763 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.0 m -72.08 -45.08 62.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.156 0.503 . . . . 52.439999999999998 110.885 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.46 ' HG2' HD21 ' A' ' 50' ' ' LEU . 19.3 mt-30 -80.68 -10.46 59.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.119 -0.491 . . . . 74.209999999999994 111.458 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 42' ' ' ARG . 4.8 tpt180 -56.27 -28.89 60.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.597 0.713 . . . . 55.219999999999999 109.429 171.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -88.08 -58.24 2.64 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.723 -1.126 . . . . 61.420000000000002 111.076 177.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.4 mmt -56.7 -33.02 66.04 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.747 -0.661 . . . . 75.329999999999998 112.105 -172.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.654 ' HA ' HD12 ' A' ' 50' ' ' LEU . 4.0 tmm_? -58.1 -50.53 73.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.324 -0.398 . . . . 75.109999999999999 111.115 -175.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -81.73 -16.59 50.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.011 0.434 . . . . 72.530000000000001 111.158 -174.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -99.65 3.64 45.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.141 -0.481 . . . . 74.230000000000004 111.483 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 64.0 27.17 70.94 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 120.779 -0.724 . . . . 75.349999999999994 112.315 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.747 ' HE2' ' HA ' ' A' ' 49' ' ' LYS . 10.3 mmpt? -99.34 -6.52 27.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.158 0.504 . . . . 73.200000000000003 109.85 -178.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.8 HD23 ' HD2' ' A' ' 51' ' ' PRO . 2.2 mt -62.32 141.02 96.4 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 115.161 -0.927 . . . . 72.510000000000005 110.258 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.8 ' HD2' HD23 ' A' ' 50' ' ' LEU . 64.5 Cg_endo -76.75 154.89 34.73 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.801 2.334 . . . . 62.119999999999997 112.997 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -71.76 -54.24 10.85 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.047 -0.979 . . . . 63.43 112.012 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.11 -34.88 64.06 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.023 0.44 . . . . 53.299999999999997 110.874 -175.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.667 ' HD3' ' CZ2' ' A' ' 37' ' ' TRP . 3.0 tmm_? -56.37 -42.85 78.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.403 -0.817 . . . . 73.510000000000005 110.134 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -67.0 -47.25 72.04 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 120.579 -0.448 . . . . 73.340000000000003 110.694 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.66 -39.82 91.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.931 -0.577 . . . . 53.149999999999999 110.993 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.429 HD22 ' HE1' ' A' ' 9' ' ' TRP . 9.1 mp -67.08 -37.05 83.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.109 -0.496 . . . . 72.319999999999993 110.958 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.869 HD11 HD21 ' A' ' 16' ' ' LEU . 3.8 mm? -67.78 -35.63 79.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.216 0.531 . . . . 65.510000000000005 110.411 176.073 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -64.51 -37.23 86.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.93 -0.577 . . . . 61.009999999999998 110.628 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -72.18 -31.88 66.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 74.209999999999994 112.19 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.8 HD11 HD13 ' A' ' 58' ' ' LEU . 25.1 pt -84.41 -12.92 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.598 -0.441 . . . . 62.409999999999997 110.751 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.28 34.85 4.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 72.530000000000001 113.534 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.427 ' CG ' HD12 ' A' ' 58' ' ' LEU . 81.0 t80 -74.49 126.51 30.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.893 0.378 . . . . 73.099999999999994 110.27 177.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.6 p . . . . . 0 N--CA 1.447 -0.595 0 CA-C-N 115.887 -0.597 . . . . 63.130000000000003 110.708 -178.042 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 54' ' ' ARG . 22.7 t-105 . . . . . 0 N--CA 1.457 -0.093 0 N-CA-C 110.182 -0.303 . . . . 71.439999999999998 110.182 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.462 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.5 tpt -55.73 -41.04 73.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.999 -0.546 . . . . 51.549999999999997 110.812 178.259 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -67.33 -53.8 26.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 73.219999999999999 110.392 -178.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -61.25 -32.04 71.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 65.239999999999995 111.172 -179.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.434 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.8 t80 -63.43 -41.3 98.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 72.319999999999993 110.24 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.479 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 35.1 mm-40 -62.47 -42.19 99.3 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.476 -0.329 . . . . 72.5 110.508 178.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.528 ' HB3' HD11 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -60.96 -49.63 76.66 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.168 0.509 . . . . 53.439999999999998 110.37 174.052 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.428 HD21 ' CD1' ' A' ' 58' ' ' LEU . 27.0 tp -56.4 -51.63 67.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.205 -0.907 . . . . 73.299999999999997 111.611 -177.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.479 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 49.4 mtpt -50.92 -54.28 25.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.226 0.536 . . . . 63.229999999999997 110.705 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.647 ' O ' ' HD3' ' A' ' 22' ' ' LYS . 13.4 t -62.43 -46.88 86.52 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.116 -0.947 . . . . 62.43 111.146 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.644 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 10.5 t80 -70.26 -43.24 70.91 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.627 -0.26 . . . . 72.120000000000005 111.544 -172.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.606 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 91.7 t -67.58 -38.44 80.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.987 -0.285 . . . . 51.030000000000001 110.821 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.477 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -59.46 -28.86 67.37 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.074 0.464 . . . . 74.540000000000006 109.935 176.684 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.647 ' HD3' ' O ' ' A' ' 18' ' ' SER . 5.1 mptp? -79.71 -66.83 0.82 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.87 -0.605 . . . . 63.399999999999999 111.586 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.433 ' CD2' ' HB3' ' A' ' 22' ' ' LYS . 85.1 m-85 -113.59 0.86 14.77 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.926 0.713 . . . . 75.340000000000003 112.926 -169.001 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.606 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 15.1 mmt85 64.52 9.28 4.92 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.006 0.522 . . . . 75.040000000000006 112.18 177.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.7 ptt180 -178.06 178.19 0.96 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.585 -0.524 . . . . 74.109999999999999 109.585 -174.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.644 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 8.9 m-85 . . . . . 0 C--N 1.326 -0.416 0 N-CA-C 109.411 -0.589 . . . . 72.120000000000005 109.411 173.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.419 HD21 ' HG2' ' A' ' 15' ' ' GLU . 29.8 p-10 . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.027 0.38 . . . . 73.030000000000001 112.027 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.575 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 95.3 mt -75.71 -34.48 60.38 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 112.685 0.624 . . . . 72.109999999999999 112.685 -173.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.03 -40.36 98.39 Favored Glycine 0 N--CA 1.451 -0.321 0 N-CA-C 111.559 -0.616 . . . . 73.299999999999997 111.559 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.15 -28.77 43.7 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.396 -0.907 . . . . 42.219999999999999 111.381 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.618 ' HH2' HD21 ' A' ' 58' ' ' LEU . 20.0 t90 -56.75 -55.86 28.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 71.140000000000001 110.914 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.516 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 8.3 p -63.4 -42.29 98.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.465 . . . . 70.030000000000001 111.152 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -65.2 -28.78 69.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.026 -0.533 . . . . 61.219999999999999 111.72 -177.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.5 m -83.86 -39.2 20.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.926 0.393 . . . . 65.0 110.835 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.61 -30.83 70.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.310000000000002 111.954 -178.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -53.93 -38.86 65.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.1 0.476 . . . . 64.329999999999998 110.598 177.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.516 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 3.5 tmmm? -71.21 -37.06 72.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.579 -0.737 . . . . 70.150000000000006 111.035 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.5 mmt -62.5 -39.95 95.14 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.04 0.448 . . . . 73.340000000000003 110.655 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.49 ' N ' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -70.29 -48.36 57.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.615 -0.72 . . . . 74.140000000000001 110.55 -175.742 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 51.4 pttt -63.09 -24.95 68.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.123 0.487 . . . . 61.350000000000001 110.422 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -87.42 -1.33 57.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.863 -0.608 . . . . 74.150000000000006 111.169 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 58.74 30.92 66.57 Favored Glycine 0 N--CA 1.452 -0.269 0 CA-C-N 116.053 -0.521 . . . . 75.430000000000007 113.308 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.07 -0.8 11.03 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.607 -0.349 . . . . 73.510000000000005 111.501 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.758 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -61.33 140.23 94.61 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.096 -0.502 . . . . 74.450000000000003 109.711 172.307 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.758 ' HD2' HD23 ' A' ' 50' ' ' LEU . 55.3 Cg_endo -73.83 150.21 43.88 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.23 1.954 . . . . 72.349999999999994 112.231 178.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -69.61 -30.19 67.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.42 -0.809 . . . . 72.230000000000004 110.36 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.655 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 6.4 m-20 -69.69 -51.78 31.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.547 -0.751 . . . . 74.219999999999999 109.846 -175.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.638 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -56.54 -53.53 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.963 -1.017 . . . . 71.439999999999998 111.147 179.147 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -65.69 -24.74 67.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.414 -0.357 . . . . 72.209999999999994 111.055 -176.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.99 -38.58 64.1 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.72 -0.474 . . . . 64.030000000000001 109.72 176.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 82.7 mt -59.34 -44.18 92.67 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.801 -0.636 . . . . 74.209999999999994 110.01 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.618 HD21 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -62.02 -43.01 99.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.665 -0.698 . . . . 71.120000000000005 110.876 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.42 -33.78 74.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.517 -0.311 . . . . 72.109999999999999 110.86 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -64.14 -41.24 97.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 62.329999999999998 111.418 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.423 HG13 HG11 ' A' ' 20' ' ' VAL . 13.1 pt -83.12 -5.95 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.884 0.374 . . . . 71.549999999999997 110.893 177.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.442 ' HA3' ' NH1' ' A' ' 24' ' ' ARG . . . 85.96 41.32 7.19 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.027 -0.606 . . . . 65.310000000000002 113.24 173.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.456 ' CG ' HD12 ' A' ' 58' ' ' LEU . 78.6 t80 -81.19 135.54 35.77 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.128 0.49 . . . . 74.049999999999997 110.856 178.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.5 t . . . . . 0 C--N 1.318 -0.796 0 CA-C-N 115.578 -0.737 . . . . 61.219999999999999 110.299 176.658 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.606 ' CZ2' ' HD3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.117 0 N-CA-C 108.913 -0.773 . . . . 71.239999999999995 108.913 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.456 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 18.4 mmt -57.73 -34.78 69.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.551 -0.75 . . . . 70.030000000000001 111.419 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.513 ' HE3' ' OE1' ' A' ' 15' ' ' GLU . 18.8 ttpt -66.85 -52.93 37.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.392 -0.367 . . . . 65.099999999999994 110.059 178.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.45 -34.9 77.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.839 -0.619 . . . . 51.539999999999999 110.862 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -59.04 -50.24 74.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 71.209999999999994 110.519 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -63.98 -35.93 82.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.386 -0.37 . . . . 70.420000000000002 111.422 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.513 ' OE1' ' HE3' ' A' ' 11' ' ' LYS . 32.8 mt-10 -73.21 -34.86 66.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.472 -0.331 . . . . 73.019999999999996 110.745 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.697 HD23 HD22 ' A' ' 58' ' ' LEU . 39.4 tp -73.08 -42.28 63.18 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.732 -0.84 . . . . 73.549999999999997 108.732 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -52.2 -49.3 64.17 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.054 -1.43 . . . . 75.319999999999993 110.965 174.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -62.74 -38.06 89.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 50.520000000000003 110.501 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.35 -39.91 62.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.669 0.271 . . . . 74.349999999999994 111.247 -175.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.27 -34.37 66.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.94 0.4 . . . . 73.099999999999994 110.291 174.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -71.15 -39.22 72.08 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.987 0.422 . . . . 74.219999999999999 110.08 175.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -65.06 -61.2 2.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.594 -0.73 . . . . 74.239999999999995 112.463 -177.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -122.54 -7.28 8.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.005 0.372 . . . . 73.129999999999995 112.005 -171.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 2.6 mmm180 64.55 99.79 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 O-C-N 123.527 0.517 . . . . 73.340000000000003 109.904 -173.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' HB3' ' O ' ' A' ' 24' ' ' ARG . 74.7 ttt180 67.28 172.16 0.26 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.781 -0.645 . . . . 75.010000000000005 109.634 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 . . . . . 0 C--N 1.323 -0.579 0 N-CA-C 110.35 -0.241 . . . . 62.109999999999999 110.35 -179.913 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.476 ' N ' HD21 ' A' ' 33' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 121.18 0.514 . . . . 74.239999999999995 110.666 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.79 -24.75 59.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 71.340000000000003 110.335 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.78 -37.79 92.97 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.3 -0.864 . . . . 51.229999999999997 111.668 175.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.35 -33.34 53.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.493 -0.861 . . . . 53.509999999999998 111.663 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -63.88 -47.23 81.47 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.088 0.47 . . . . 71.340000000000003 110.637 -179.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.0 p -71.61 -30.21 65.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.196 -0.457 . . . . 64.239999999999995 111.28 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -53.33 -38.89 63.63 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.096 0.474 . . . . 75.209999999999994 110.891 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.414 ' HA ' ' HD3' ' A' ' 43' ' ' LYS . 95.3 m -73.28 -39.87 65.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 65.439999999999998 111.257 178.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.436 ' OE1' ' HD2' ' A' ' 54' ' ' ARG . 31.8 mt-30 -85.41 -21.15 28.91 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.014 0.746 . . . . 75.439999999999998 113.014 -171.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.445 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -66.05 -27.91 68.45 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 43.520000000000003 109.497 175.012 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.445 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 16.4 mtpp -67.83 -50.45 56.62 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.233 -0.654 . . . . 74.519999999999996 109.233 172.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.698 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 18.1 mmt -55.39 -37.66 67.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.015 -0.993 . . . . 72.040000000000006 110.916 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.769 ' HB2' HD12 ' A' ' 50' ' ' LEU . 4.2 tmm_? -77.17 -41.24 42.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 61.219999999999999 110.749 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.47 -40.45 93.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.281 0.562 . . . . 74.349999999999994 109.633 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.473 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 4.3 tp-100 -70.52 -29.24 65.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.68 -0.691 . . . . 64.129999999999995 110.346 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.5 35.8 9.17 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.83 -0.7 . . . . 61.219999999999999 112.228 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.473 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 17.7 ptmt -124.24 3.51 8.52 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.57 0.211 . . . . 64.319999999999993 111.57 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.769 HD12 ' HB2' ' A' ' 45' ' ' ARG . 4.0 mt -62.38 140.29 96.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.026 -0.361 . . . . 72.150000000000006 110.026 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.719 ' HG2' ' HB3' ' A' ' 54' ' ' ARG . 66.5 Cg_endo -75.6 135.1 17.6 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.708 2.272 . . . . 55.539999999999999 111.862 175.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.544 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 27.8 p-10 -69.56 -24.74 63.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.826 -0.625 . . . . 72.420000000000002 111.414 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.613 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 29.1 m-20 -64.92 -51.77 60.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.758 0.313 . . . . 75.439999999999998 110.686 177.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.719 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -62.94 -42.1 99.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 74.430000000000007 110.37 175.48 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.544 ' HB3' ' HA ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -53.27 -40.8 64.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.593 -0.73 . . . . 71.109999999999999 111.017 172.847 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -69.13 -44.69 71.86 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.973 -0.38 . . . . 54.32 109.973 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 85.8 mt -55.22 -47.3 75.55 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.254 -0.43 . . . . 75.549999999999997 111.282 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.697 HD22 HD23 ' A' ' 16' ' ' LEU . 39.0 mt -71.52 -37.86 71.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.975 -0.557 . . . . 73.540000000000006 110.77 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -69.86 -24.53 63.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.208 -0.451 . . . . 72.109999999999999 110.908 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -42.81 70.74 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 116.062 -0.517 . . . . 73.430000000000007 110.446 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 15.4 pt -73.49 -33.86 40.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 120.914 0.388 . . . . 70.510000000000005 110.343 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 131.6 33.47 0.44 Allowed Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.454 -0.879 . . . . 72.430000000000007 113.368 173.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -87.17 102.45 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.29 0.566 . . . . 60.299999999999997 109.52 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.8 p . . . . . 0 N--CA 1.444 -0.734 0 CA-C-N 115.112 -0.949 . . . . 64.349999999999994 110.89 -175.837 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.363 0.125 . . . . 72.510000000000005 110.669 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.448 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 20.0 mmt -60.4 -39.96 89.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.065 0.46 . . . . 74.420000000000002 110.89 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 36.8 ttpt -69.5 -55.03 11.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 73.019999999999996 110.66 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -64.54 -33.35 75.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.706 -0.679 . . . . 73.400000000000006 111.933 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.434 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.7 t80 -59.08 -51.87 68.2 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 122.999 0.187 . . . . 74.420000000000002 110.503 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.814 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 73.6 mm-40 -59.6 -39.25 83.58 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.071 0.462 . . . . 73.109999999999999 111.016 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.525 ' CB ' HD21 ' A' ' 34' ' ' LEU . 52.8 mm-40 -66.15 -45.47 80.84 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 65.420000000000002 110.362 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.2 tp -62.98 -44.13 96.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.039 -0.528 . . . . 75.540000000000006 110.806 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.814 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.2 mtpt -50.99 -57.37 8.77 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.096 -0.502 . . . . 71.329999999999998 109.707 175.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -55.43 -42.76 74.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.049 -0.978 . . . . 61.119999999999997 111.951 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -62.67 -48.26 80.08 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.908 0.385 . . . . 65.239999999999995 111.353 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.715 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 32.9 t -72.3 -43.64 64.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.496 0.554 . . . . 75.519999999999996 112.496 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 17' ' ' LYS . 8.3 ppt_? -64.45 -15.76 61.26 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.954 -0.699 . . . . 75.319999999999993 110.848 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -87.25 -72.71 0.5 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.096 -0.502 . . . . 74.120000000000005 111.082 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -116.41 -6.87 11.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.32 0.489 . . . . 72.430000000000007 112.32 -170.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.715 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 12.1 mpt_? 66.05 13.71 9.23 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.851 0.46 . . . . 74.099999999999994 111.209 -176.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.7 ptt180 -161.94 175.61 11.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.586 0.231 . . . . 72.329999999999998 110.745 -175.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 73.099999999999994 110.744 175.969 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 . . . . . 0 CA--C 1.52 -0.174 0 N-CA-C 110.598 -0.149 . . . . 71.409999999999997 110.598 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.525 HD21 ' CB ' ' A' ' 15' ' ' GLU . 3.7 mm? -65.52 -32.01 73.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 74.450000000000003 110.642 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.19 -38.94 96.45 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.012 -0.614 . . . . 64.129999999999995 111.756 177.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.78 -31.53 35.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.33 -0.938 . . . . 74.219999999999999 111.561 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -58.79 -53.1 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.348 0.259 . . . . 75.420000000000002 111.063 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.7 p -62.25 -40.67 96.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.386 -0.37 . . . . 74.120000000000005 111.164 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -62.24 -45.58 92.67 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.871 0.367 . . . . 62.009999999999998 110.796 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.473 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 27.5 m -66.65 -38.38 86.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.894 -0.594 . . . . 72.230000000000004 110.856 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.595 ' HG3' HD21 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.93 -20.95 60.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.108 -0.497 . . . . 71.310000000000002 111.513 -177.169 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -59.78 -43.9 94.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.729 0.299 . . . . 70.140000000000001 110.473 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -64.78 -41.54 95.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.318 -0.401 . . . . 75.030000000000001 110.097 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.555 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 25.3 mmt -57.77 -41.55 82.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.905 -0.589 . . . . 74.430000000000007 110.414 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.548 ' C ' ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -69.84 -49.68 50.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.698 -0.683 . . . . 72.109999999999999 111.045 -178.604 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -75.88 -22.5 56.08 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.881 -0.328 . . . . 73.430000000000007 111.324 -173.212 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.54 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 17.7 tt0 -85.3 -8.72 58.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.041 0.448 . . . . 74.430000000000007 110.19 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.18 37.62 63.55 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.695 -0.684 . . . . 44.119999999999997 112.409 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 14.2 ptmt -131.95 12.45 4.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.058 0.392 . . . . 74.310000000000002 112.058 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -63.43 135.32 96.2 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 108.527 -0.916 . . . . 75.019999999999996 108.527 176.391 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.763 ' HG2' HH11 ' A' ' 54' ' ' ARG . 20.5 Cg_exo -69.12 138.79 40.75 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.835 2.356 . . . . 65.040000000000006 113.109 -177.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.477 ' HA ' ' HG2' ' A' ' 55' ' ' ARG . 89.1 m-20 -69.51 -31.07 69.09 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.842 -1.072 . . . . 74.010000000000005 110.136 176.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.62 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 13.1 t70 -71.26 -47.9 54.26 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.531 -0.759 . . . . 74.120000000000005 110.144 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.763 HH11 ' HG2' ' A' ' 51' ' ' PRO . 3.2 ttm105 -61.95 -42.73 99.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 64.030000000000001 111.12 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.477 ' HG2' ' HA ' ' A' ' 52' ' ' ASN . 18.4 ptp180 -66.44 -31.92 72.97 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 109.745 -0.465 . . . . 72.239999999999995 109.745 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.16 -37.97 75.33 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.255 -0.429 . . . . 44.509999999999998 110.216 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.5 mt -59.84 -38.83 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 72.430000000000007 110.391 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 54' ' ' ARG . 9.9 mp -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 75.420000000000002 110.655 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.33 -36.56 82.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.814 0.34 . . . . 63.43 110.793 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -67.59 -40.01 84.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 74.040000000000006 111.671 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.435 HG21 ' HG2' ' A' ' 17' ' ' LYS . 33.6 pt -76.31 -14.03 14.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 120.579 -0.448 . . . . 35.43 110.877 178.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 110.74 20.16 7.42 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.624 -0.798 . . . . 61.409999999999997 113.582 173.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -68.32 130.67 43.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.299 0.571 . . . . 71.5 110.603 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.441 -0.879 0 CA-C-N 115.203 -0.908 . . . . 73.019999999999996 109.801 179.817 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.588 ' HZ2' ' HA ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.504 0 N-CA-C 109.897 -0.408 . . . . 64.319999999999993 109.897 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.429 ' SD ' ' N ' ' A' ' 10' ' ' MET . 1.5 mpt? -60.78 -38.15 84.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.992 -0.549 . . . . 75.439999999999998 110.762 -177.657 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.7 OUTLIER -69.95 -48.45 58.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.79 -0.641 . . . . 75.439999999999998 109.939 179.767 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -63.95 -35.83 81.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.996 -0.547 . . . . 64.340000000000003 110.673 178.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -61.62 -54.94 36.2 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 115.737 -0.665 . . . . 71.409999999999997 110.135 -177.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -62.57 -29.57 70.68 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.885 -0.326 . . . . 74.340000000000003 111.321 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 46.0 mt-10 -65.31 -39.46 92.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.054 0.454 . . . . 72.099999999999994 110.312 175.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -87.66 -35.14 18.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.765 -0.652 . . . . 74.430000000000007 109.734 -173.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -58.68 -47.73 83.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.527 -0.76 . . . . 64.530000000000001 110.568 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.3 t -69.97 -26.94 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.919 -0.582 . . . . 73.319999999999993 110.202 178.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.491 ' HE1' ' HA ' ' A' ' 26' ' ' PHE . 37.9 t80 -75.14 -52.26 11.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.175 -0.466 . . . . 73.109999999999999 110.547 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.623 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 8.2 p -62.85 -33.79 62.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 73.109999999999999 111.984 -176.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -76.17 -20.07 57.87 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.005 -0.434 . . . . 75.319999999999993 111.001 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.425 ' HD3' ' CE2' ' A' ' 23' ' ' TYR . 62.9 tttm -95.49 -55.32 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.647 0.261 . . . . 75.230000000000004 111.069 -179.125 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.425 ' CE2' ' HD3' ' A' ' 22' ' ' LYS . 84.6 m-85 -93.84 -18.9 21.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.715 0.265 . . . . 65.040000000000006 111.715 -173.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.623 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 30.3 mmm180 64.0 87.07 0.11 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.489 0.662 . . . . 72.299999999999997 110.618 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.439 ' H ' HG23 ' A' ' 20' ' ' VAL . 0.1 OUTLIER 68.89 176.19 0.27 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.417 -1.265 . . . . 72.409999999999997 111.208 -173.829 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.653 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 81.7 m-85 . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.529 -0.759 . . . . 73.439999999999998 110.455 175.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 . . . . . 0 N--CA 1.463 0.208 0 CA-C-O 120.677 0.275 . . . . 50.439999999999998 111.654 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.653 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 87.3 mt -60.81 -37.74 82.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.342 -0.39 . . . . 75.310000000000002 111.655 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.74 92.17 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.983 -0.627 . . . . 74.319999999999993 112.014 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.68 -38.96 12.73 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.719 -0.753 . . . . 72.299999999999997 111.68 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -55.17 -42.34 73.05 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 122.779 0.431 . . . . 71.430000000000007 111.097 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.1 t -65.98 -39.41 90.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.034 -0.53 . . . . 62.409999999999997 110.553 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -70.31 -37.26 74.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 71.329999999999998 111.727 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.6 m -68.93 -45.31 71.15 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.134 0.492 . . . . 72.319999999999993 110.838 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.73 ' HG3' HD21 ' A' ' 50' ' ' LEU . 2.8 mp0 -75.89 -17.24 59.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.085 -0.507 . . . . 63.439999999999998 111.588 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.5 tpt85 -59.87 -34.98 73.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.385 0.612 . . . . 72.010000000000005 109.863 173.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -74.14 -48.25 30.65 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.134 -0.939 . . . . 74.209999999999994 111.086 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.721 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.3 mmt -63.25 -29.57 70.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.885 -0.598 . . . . 72.439999999999998 110.987 -177.051 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -61.32 -50.39 73.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.836 -0.62 . . . . 74.400000000000006 111.172 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.418 ' HB2' ' HE3' ' A' ' 46' ' ' LYS . 20.4 ptmt -77.2 -18.47 57.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.047 0.451 . . . . 64.230000000000004 111.038 -175.358 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -84.75 -13.77 50.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.099 -0.5 . . . . 52.420000000000002 110.492 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.99 25.49 75.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.926 -0.654 . . . . 42.310000000000002 112.176 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.459 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.0 ptmt -109.99 -0.95 17.91 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.104 0.478 . . . . 73.420000000000002 110.303 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.73 HD21 ' HG3' ' A' ' 41' ' ' GLN . 4.7 mt -62.2 140.79 96.17 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.59 -0.732 . . . . 72.150000000000006 109.917 175.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.487 ' HB2' ' HB3' ' A' ' 54' ' ' ARG . 23.9 Cg_exo -65.83 127.27 17.49 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.303 2.002 . . . . 75.120000000000005 110.747 172.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -59.04 -33.7 71.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.828 -0.623 . . . . 64.129999999999995 110.63 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.668 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 30.8 m-20 -65.5 -46.71 78.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.199 -0.455 . . . . 73.219999999999999 110.023 175.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.588 ' HA ' ' HZ2' ' A' ' 9' ' ' TRP . 31.8 tpt85 -56.42 -33.48 65.87 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.082 0.467 . . . . 74.239999999999995 110.869 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -73.15 -38.93 66.06 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.337 -0.392 . . . . 73.409999999999997 110.843 176.74 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.7 tp -76.34 -40.15 52.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.581 -0.281 . . . . 54.340000000000003 111.194 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 63.3 mt -59.31 -33.72 71.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.93 0.395 . . . . 74.540000000000006 111.042 -178.3 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.525 ' HG ' ' NH1' ' A' ' 54' ' ' ARG . 3.2 mm? -71.97 -43.86 64.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 71.340000000000003 110.446 176.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.039 -0.528 . . . . 64.329999999999998 110.26 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 59.7 mmtt -53.04 -46.94 68.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.467 -0.788 . . . . 70.230000000000004 110.991 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 7.4 pt -89.87 1.83 7.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.701 -0.681 . . . . 72.319999999999993 111.887 -174.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.21 24.44 8.95 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.323 -0.941 . . . . 51.43 113.666 174.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.45 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 34.9 t80 -89.41 101.45 14.13 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.535 -0.913 . . . . 74.140000000000001 108.535 173.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 C--N 1.318 -0.782 0 CA-C-N 115.281 -0.872 . . . . 62.039999999999999 111.916 -171.77 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 . . . . . 0 CA--C 1.524 -0.054 0 N-CA-C 110.14 -0.318 . . . . 72.120000000000005 110.14 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.457 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.5 tpt -63.54 -34.92 78.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.101 0.477 . . . . 73.530000000000001 110.182 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.417 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.86 -48.21 39.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 73.400000000000006 110.556 -178.111 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -67.55 -39.47 84.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 64.349999999999994 111.465 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -62.83 -42.78 99.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.117 -0.233 . . . . 74.329999999999998 110.834 -176.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.99 -42.75 97.1 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.084 0.469 . . . . 64.040000000000006 110.869 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.99 -36.61 82.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.688 -0.687 . . . . 71.120000000000005 110.57 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 tp -81.96 -33.84 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 72.340000000000003 109.903 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -57.11 -52.05 66.85 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.699 -0.682 . . . . 70.319999999999993 109.999 175.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 m -68.51 -31.08 70.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.328 -0.851 . . . . 74.510000000000005 110.84 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -70.44 -50.63 36.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.428 -0.351 . . . . 64.209999999999994 110.316 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.638 ' HA ' ' H ' ' A' ' 25' ' ' ARG . 71.8 t -68.74 -36.88 76.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 CA-C-N 116.634 -0.257 . . . . 63.030000000000001 111.078 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -31.61 72.91 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.676 -0.41 . . . . 75.299999999999997 110.89 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -94.41 -54.32 3.58 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.934 0.346 . . . . 74.299999999999997 111.934 -175.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -97.57 -9.38 27.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.605 0.24 . . . . 72.420000000000002 111.417 -175.07 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.595 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 25.5 mmt180 55.78 79.97 0.15 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.84 -0.618 . . . . 72.510000000000005 111.558 -174.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.751 ' HD3' HG12 ' A' ' 64' ' ' VAL . 22.6 mtt180 70.25 171.74 0.31 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.13 -0.941 . . . . 65.310000000000002 111.017 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 1.3 p90 . . . . . 0 C--N 1.324 -0.517 0 CA-C-O 121.235 0.54 . . . . 70.530000000000001 110.474 172.656 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.2 m120 . . . . . 0 N--CA 1.467 0.416 0 CA-C-O 120.848 0.356 . . . . 74.450000000000003 111.406 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.28 -33.47 73.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.533 . . . . 75.239999999999995 111.217 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.29 -49.79 73.92 Favored Glycine 0 CA--C 1.5 -0.869 0 C-N-CA 120.745 -0.74 . . . . 64.549999999999997 111.324 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.18 -31.24 71.81 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.561 -0.828 . . . . 43.049999999999997 111.139 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.648 ' HH2' HD21 ' A' ' 58' ' ' LEU . 7.7 t90 -56.17 -56.13 24.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.25 0.547 . . . . 64.409999999999997 109.954 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.3 t -71.19 -44.98 64.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.511 -0.768 . . . . 64.219999999999999 111.477 -177.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -57.68 -28.63 63.96 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.812 0.339 . . . . 65.150000000000006 111.635 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.1 m -84.38 -51.15 7.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.17 0.509 . . . . 71.019999999999996 111.162 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.522 ' HB3' HD11 ' A' ' 50' ' ' LEU . 61.1 mt-30 -76.6 -24.22 53.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.946 0.721 . . . . 74.349999999999994 112.946 -170.203 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.565 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 13.2 ttt180 -55.83 -42.53 75.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.474 0.654 . . . . 70.239999999999995 109.404 173.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -76.11 -32.13 59.03 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.577 -0.738 . . . . 61.119999999999997 110.075 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 14.8 mmt -60.53 -45.76 92.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.398 -0.364 . . . . 65.400000000000006 111.521 176.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.605 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -65.58 -33.15 75.23 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.824 -0.35 . . . . 73.319999999999993 110.766 -177.974 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.469 ' HB2' HH11 ' A' ' 45' ' ' ARG . 5.2 tmmm? -73.87 -36.66 64.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.471 0.653 . . . . 71.230000000000004 109.53 176.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -73.56 -14.98 61.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.338 -0.846 . . . . 74.049999999999997 110.653 -178.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.624 ' C ' ' HE3' ' A' ' 49' ' ' LYS . . . 82.26 21.75 60.1 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.071 -0.585 . . . . 71.439999999999998 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.624 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 0.1 OUTLIER -95.09 -14.23 24.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.621 . . . . 32.32 110.535 -177.38 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.73 HD23 ' HD2' ' A' ' 51' ' ' PRO . 3.5 mt -93.6 141.74 24.25 Favored Pre-proline 0 C--N 1.315 -0.902 0 CA-C-N 115.315 -0.857 . . . . 64.409999999999997 110.248 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.73 ' HD2' HD23 ' A' ' 50' ' ' LEU . 83.7 Cg_endo -85.16 161.01 11.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.634 2.223 . . . . 65.439999999999998 111.736 170.232 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -71.35 -24.15 62.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.894 -0.594 . . . . 74.040000000000006 110.064 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.12 -51.75 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.734 -0.666 . . . . 74.239999999999995 111.192 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.4 ttm180 -67.87 -49.19 63.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.085 0.469 . . . . 74.209999999999994 110.376 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.52 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -50.41 -36.59 33.67 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.388 -0.824 . . . . 73.129999999999995 111.324 177.532 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.3 tp -68.35 -42.96 78.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 75.299999999999997 111.096 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.0 mp -62.35 -34.32 76.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.806 0.336 . . . . 64.209999999999994 110.869 178.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.648 HD21 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -65.65 -38.95 90.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.372 0.606 . . . . 54.350000000000001 110.473 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.52 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 12.4 t70 -64.94 -38.1 89.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.89 -0.595 . . . . 62.240000000000002 110.332 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -63.51 -41.7 98.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.775 -0.648 . . . . 74.319999999999993 111.969 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.453 HD11 HD13 ' A' ' 58' ' ' LEU . 35.3 pt -76.27 -16.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.563 -0.455 . . . . 63.009999999999998 110.906 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.67 33.6 3.28 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.731 -0.747 . . . . 45.539999999999999 112.984 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.429 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 48.0 t80 -93.79 133.78 36.81 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.072 0.463 . . . . 64.040000000000006 110.51 178.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.751 HG12 ' HD3' ' A' ' 25' ' ' ARG . 14.3 p . . . . . 0 N--CA 1.444 -0.749 0 CA-C-N 115.782 -0.644 . . . . 61.539999999999999 109.87 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.499 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 23.8 t-105 . . . . . 0 N--CA 1.462 0.17 0 N-CA-C 111.866 0.321 . . . . 70.120000000000005 111.866 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.513 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 12.0 mmt -54.35 -37.82 65.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.088 0.47 . . . . 53.409999999999997 111.131 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -79.36 -49.09 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.965 -0.561 . . . . 71.099999999999994 110.243 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -52.71 -47.25 67.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.924 -1.035 . . . . 63.329999999999998 111.464 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -54.72 -51.94 64.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.861 -0.608 . . . . 70.140000000000001 110.934 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -66.72 -36.5 82.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 72.310000000000002 111.687 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.99 -36.53 69.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.178 -0.464 . . . . 74.409999999999997 110.631 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.455 HD23 ' O ' ' A' ' 16' ' ' LEU . 4.2 tt -77.36 -35.69 54.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.188 -1.041 . . . . 75.439999999999998 108.188 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.65 -42.09 74.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.785 -1.098 . . . . 63.039999999999999 110.395 174.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -74.85 -29.95 61.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.631 -0.713 . . . . 72.349999999999994 110.925 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -75.4 -46.18 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 73.349999999999994 111.435 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.567 HG11 ' HB ' ' A' ' 61' ' ' ILE . 8.1 p -65.25 -34.15 68.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.573 -0.285 . . . . 72.049999999999997 111.205 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -78.86 -16.42 57.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.137 0.494 . . . . 73.450000000000003 110.147 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -77.8 -67.43 0.73 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.805 -0.634 . . . . 74.150000000000006 110.986 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -116.86 12.98 14.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.621 0.23 . . . . 73.450000000000003 111.621 -176.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 16.1 mmt180 62.31 88.26 0.09 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.722 0.639 . . . . 72.409999999999997 110.733 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.475 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 tmt_? 70.57 166.0 0.29 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.581 -0.736 . . . . 55.149999999999999 109.317 -177.275 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.8 p90 . . . . . 0 C--N 1.32 -0.705 0 CA-C-O 121.151 0.501 . . . . 74.329999999999998 111.3 -179.72 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 . . . . . 0 CA--C 1.522 -0.111 0 N-CA-C 111.525 0.195 . . . . 72.340000000000003 111.525 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.1 mt -58.63 -42.56 88.54 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.738 0.304 . . . . 74.129999999999995 111.066 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -57.81 -42.99 94.84 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.078 -0.582 . . . . 74.340000000000003 111.956 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.79 -39.8 76.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.848 -0.691 . . . . 65.129999999999995 111.528 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -54.64 -48.97 71.63 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.483 -0.562 . . . . 73.430000000000007 109.483 176.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -64.07 -51.42 64.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.134 -0.939 . . . . 74.439999999999998 110.877 178.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -52.72 -44.71 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.363 0.505 . . . . 52.329999999999998 112.363 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 46.0 m -70.9 -45.23 64.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.158 0.504 . . . . 73.140000000000001 111.264 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.45 ' HG2' HD21 ' A' ' 50' ' ' LEU . 33.9 mt-30 -86.44 -12.58 48.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.764 1.024 . . . . 72.439999999999998 113.764 -171.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -73.74 -4.73 36.37 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.297 0.57 . . . . 72.040000000000006 109.952 174.026 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.743 ' HD3' ' HG3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -92.67 -47.78 6.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.504 -0.771 . . . . 63.310000000000002 108.982 172.299 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.754 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 12.5 mmt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.573 -0.739 . . . . 75.209999999999994 111.231 -175.168 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.649 ' HG3' ' N ' ' A' ' 46' ' ' LYS . 14.1 ptt180 -52.37 -49.34 64.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.991 -0.55 . . . . 74.450000000000003 111.519 -178.172 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.649 ' N ' ' HG3' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -82.2 -43.7 17.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.867 -0.606 . . . . 71.329999999999998 109.854 -175.513 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.743 ' HG3' ' HD3' ' A' ' 43' ' ' LYS . 10.9 mm-40 -60.91 -18.0 54.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.378 -0.828 . . . . 73.310000000000002 111.688 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.24 36.24 24.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.924 -0.655 . . . . 75.150000000000006 111.522 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.762 ' HE2' ' HA ' ' A' ' 49' ' ' LYS . 9.8 mmpt? -108.65 -10.25 15.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 71.5 110.066 -177.08 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.661 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 11.0 mt -75.38 142.6 75.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 74.109999999999999 111.226 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -70.92 137.92 33.06 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.745 2.296 . . . . 74.140000000000001 110.947 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.585 ' HA ' ' CG ' ' A' ' 55' ' ' ARG . 74.3 m-20 -63.82 -22.49 66.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.613 -0.721 . . . . 75.209999999999994 111.965 -177.479 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.764 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 20.2 m-20 -64.27 -52.74 57.18 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.445 -0.576 . . . . 64.329999999999998 109.445 179.179 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -63.8 -47.12 82.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.662 -0.699 . . . . 63.340000000000003 111.295 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.585 ' CG ' ' HA ' ' A' ' 52' ' ' ASN . 7.7 ppt_? -65.51 -23.65 66.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.003 0.43 . . . . 73.219999999999999 110.539 -175.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.6 tp -82.35 -37.43 25.68 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.816 -0.438 . . . . 62.200000000000003 109.816 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 41.4 mt -66.39 -43.75 84.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 73.200000000000003 110.538 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.407 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 94.7 mt -64.32 -44.07 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.128 -0.487 . . . . 54.229999999999997 110.621 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -68.88 -20.39 64.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.17 0.51 . . . . 75.109999999999999 110.353 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -79.55 -39.73 31.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.802 -0.635 . . . . 75.239999999999995 110.767 177.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.567 ' HB ' HG11 ' A' ' 20' ' ' VAL . 19.4 pt -80.99 -9.8 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.662 0.268 . . . . 72.030000000000001 111.366 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.76 6.44 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.624 -0.798 . . . . 43.049999999999997 112.816 175.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.407 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 85.6 t80 -84.07 120.48 26.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.09 0.471 . . . . 71.5 110.309 179.084 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--N 1.321 -0.652 0 CA-C-N 115.34 -0.845 . . . . 62.409999999999997 110.068 178.255 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.477 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 11.7 t-105 . . . . . 0 C--O 1.224 -0.273 0 CA-C-O 121.298 0.57 . . . . 60.030000000000001 109.981 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.542 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 15.2 mmt -66.1 -23.95 66.6 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.967 -0.561 . . . . 64.140000000000001 110.791 177.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 -51.49 9.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.065 -0.516 . . . . 74.109999999999999 110.379 179.234 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -78.1 -25.22 47.44 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.579 0.585 . . . . 71.329999999999998 112.579 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -62.46 -52.51 63.22 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 121.096 -0.242 . . . . 73.239999999999995 110.727 177.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 10' ' ' MET . 8.4 pt-20 -68.45 -25.26 64.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.349 0.595 . . . . 74.450000000000003 110.157 177.397 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' O ' HD11 ' A' ' 34' ' ' LEU . 12.2 tt0 -68.66 -31.83 71.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.363 -0.835 . . . . 70.349999999999994 109.844 178.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.559 HD22 ' CZ3' ' A' ' 37' ' ' TRP . 41.2 tp -88.81 -39.27 14.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.312 0.577 . . . . 75.120000000000005 109.571 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.472 ' HG3' HG21 ' A' ' 61' ' ' ILE . 59.2 tttm -53.29 -51.85 60.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.888 -1.051 . . . . 65.439999999999998 111.284 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.6 p -61.14 -33.53 73.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.68 -0.691 . . . . 43.409999999999997 111.463 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.555 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 14.5 t80 -75.38 -49.67 18.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.847 0.356 . . . . 75.129999999999995 110.389 -178.198 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.9 t -63.17 -36.18 74.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.177 -0.465 . . . . 63.420000000000002 110.666 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -53.83 -30.39 45.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.07 -0.514 . . . . 72.540000000000006 110.954 178.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -92.33 -56.03 3.19 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.879 -0.6 . . . . 73.140000000000001 112.042 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.94 -29.15 11.6 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 120.874 0.369 . . . . 65.540000000000006 111.113 -171.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.58 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.1 OUTLIER 62.3 104.28 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.218 -0.901 . . . . 71.129999999999995 110.192 -164.978 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.5 mmt180 77.79 153.3 0.14 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.572 -1.195 . . . . 73.409999999999997 111.625 -177.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.555 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 6.5 p90 . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 114.627 -1.169 . . . . 55.420000000000002 109.054 177.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 CA--C 1.519 -0.216 0 CA-C-O 121.329 0.585 . . . . 71.329999999999998 110.948 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.414 HD13 HD12 ' A' ' 16' ' ' LEU . 98.2 mt -74.37 -32.08 62.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.37 -0.832 . . . . 71.010000000000005 111.104 -174.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.489 ' HA2' ' HE2' ' A' ' 26' ' ' PHE . . . -61.19 -43.57 99.23 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.335 -0.936 . . . . 64.010000000000005 111.218 177.032 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.37 -30.73 66.61 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 110.986 -0.845 . . . . 50.310000000000002 110.986 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.719 ' O ' HG22 ' A' ' 40' ' ' THR . 2.1 t90 -63.79 -46.44 85.17 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.441 -0.577 . . . . 74.430000000000007 109.441 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.486 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.3 t -60.1 -45.42 93.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.089 -0.505 . . . . 73.540000000000006 110.324 176.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.423 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 74.4 m-70 -61.52 -32.43 72.48 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.277 -0.419 . . . . 65.510000000000005 111.988 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 37' ' ' TRP . 1.3 t -71.05 -39.28 72.36 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 120.438 -0.505 . . . . 52.229999999999997 110.049 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.18 -27.57 61.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.859 0.361 . . . . 51.009999999999998 110.646 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 39' ' ' HIS . 21.3 tpt180 -54.98 -44.23 74.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.67 -0.695 . . . . 70.209999999999994 109.435 171.713 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 40' ' ' THR . 20.7 mtpp -71.79 -57.03 4.7 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.09 -0.959 . . . . 70.239999999999995 110.406 177.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.712 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.0 mmt -54.63 -33.99 61.42 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.808 -0.633 . . . . 71.049999999999997 111.973 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.861 ' HB2' HD12 ' A' ' 50' ' ' LEU . 23.9 tpt180 -74.14 -47.98 32.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.738 0.304 . . . . 65.140000000000001 110.334 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.479 ' HB3' ' HE2' ' A' ' 46' ' ' LYS . 5.1 tmmm? -64.99 -29.95 70.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.173 0.511 . . . . 72.540000000000006 110.162 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -79.23 -20.72 47.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.843 -0.617 . . . . 74.0 110.647 176.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 77.34 49.76 7.17 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.684 -0.689 . . . . 43.210000000000001 113.165 176.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.63 ' HD2' ' SD ' ' A' ' 44' ' ' MET . 0.1 OUTLIER -143.32 11.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.951 0.405 . . . . 61.310000000000002 111.915 177.678 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.861 HD12 ' HB2' ' A' ' 45' ' ' ARG . 5.7 mt -69.78 140.97 89.46 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.06 -0.518 . . . . 71.349999999999994 110.329 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.504 ' HD2' ' CD2' ' A' ' 50' ' ' LEU . 76.8 Cg_endo -80.63 144.92 16.0 Favored 'Trans proline' 0 C--O 1.239 0.535 0 C-N-CA 122.805 2.336 . . . . 73.439999999999998 113.047 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -65.5 -44.72 86.16 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.846 -1.07 . . . . 70.540000000000006 111.749 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.701 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 8.6 m-20 -54.78 -52.5 62.4 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.313 -0.403 . . . . 74.549999999999997 111.528 -175.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.558 ' HB3' HH11 ' A' ' 54' ' ' ARG . 3.1 ttp-105 -57.01 -46.0 82.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 65.310000000000002 110.697 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.72 -50.15 69.02 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.041 -0.981 . . . . 73.019999999999996 109.968 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.1 tp -67.64 -34.38 76.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 55.420000000000002 111.618 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.4 mt -62.61 -31.86 72.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 75.299999999999997 110.874 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt -71.67 -36.98 70.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.065 0.46 . . . . 75.430000000000007 110.443 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.22 -33.93 72.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.211 -0.449 . . . . 72.310000000000002 110.545 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -69.42 -31.78 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 71.019999999999996 111.881 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 17' ' ' LYS . 38.9 pt -86.81 -7.13 10.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.653 -0.419 . . . . 74.209999999999994 110.903 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.21 22.81 12.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.659 -0.782 . . . . 71.150000000000006 112.77 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -82.9 108.12 16.0 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.246 0.546 . . . . 74.530000000000001 110.104 178.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.1 p . . . . . 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 73.239999999999995 110.641 -178.764 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.649 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 18.5 t-105 . . . . . 0 N--CA 1.46 0.04 0 CA-C-O 120.496 0.188 . . . . 75.040000000000006 111.278 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 45.2 ttm -58.25 -35.02 71.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.748 0.309 . . . . 73.200000000000003 110.875 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.6 tmmt? -69.36 -55.47 10.29 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.187 -0.46 . . . . 74.040000000000006 110.921 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -66.09 -32.69 74.29 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 120.513 -0.475 . . . . 75.230000000000004 111.206 -179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.592 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 36.3 t80 -63.71 -45.75 88.56 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.279 . . . . 74.329999999999998 110.672 -179.027 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.496 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 38.7 mm-40 -58.97 -35.1 72.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.812 0.339 . . . . 71.25 111.287 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -75.45 -40.03 58.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.257 0.551 . . . . 72.540000000000006 110.041 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.441 HD13 HD22 ' A' ' 34' ' ' LEU . 47.0 tp -64.5 -40.25 95.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.281 -0.872 . . . . 73.329999999999998 111.597 -178.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 13' ' ' TYR . 55.2 mtpt -51.32 -57.71 8.16 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.348 0.594 . . . . 65.510000000000005 110.388 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.1 m -63.06 -37.05 85.63 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.915 -1.039 . . . . 54.420000000000002 111.336 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.534 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 11.2 t80 -65.73 -47.16 76.27 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.932 0.396 . . . . 74.340000000000003 110.621 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 40.2 t -67.76 -34.37 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.207 -0.451 . . . . 72.420000000000002 111.193 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -69.76 -39.83 76.48 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 120.928 -0.309 . . . . 74.519999999999996 110.367 178.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.67 -52.59 11.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.391 . . . . 73.150000000000006 111.406 -174.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -96.31 -20.82 18.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.017 0.377 . . . . 74.349999999999994 112.017 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.624 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 18.8 mmt180 63.47 92.99 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 72.239999999999995 110.158 -169.332 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 15.1 ptt-85 61.18 169.84 0.1 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.542 -1.208 . . . . 74.010000000000005 111.298 -176.015 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.534 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 1.8 p90 . . . . . 0 C--N 1.323 -0.555 0 CA-C-O 121.517 0.675 . . . . 74.239999999999995 110.754 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.414 ' O ' ' HB2' ' A' ' 37' ' ' TRP . 5.3 p30 . . . . . 0 C--O 1.225 -0.214 0 CA-C-O 120.306 0.098 . . . . 71.209999999999994 110.769 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.441 HD22 HD13 ' A' ' 16' ' ' LEU . 81.1 mt -61.4 -38.93 88.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.816 0.341 . . . . 61.210000000000001 110.914 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.72 -42.97 96.63 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.895 -0.669 . . . . 72.040000000000006 112.358 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -82.21 -26.71 47.16 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.275 -0.964 . . . . 53.240000000000002 111.293 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 5.2 t90 -56.58 -56.43 21.47 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 122.951 0.5 . . . . 72.310000000000002 110.584 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.7 p -65.09 -37.06 86.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.839 -0.619 . . . . 72.340000000000003 111.579 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.448 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 24.1 m80 -73.62 -40.46 63.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 74.450000000000003 111.908 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.527 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 95.9 m -63.65 -38.07 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.006 0.431 . . . . 74.530000000000001 110.966 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.971 ' HG2' HD21 ' A' ' 50' ' ' LEU . 7.9 mt-30 -76.55 -9.62 58.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.237 -0.438 . . . . 64.140000000000001 112.089 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 39' ' ' HIS . 5.1 mpt_? -62.41 -38.98 91.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.658 -0.497 . . . . 75.430000000000007 109.658 171.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.527 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -72.37 -37.37 68.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.635 -0.711 . . . . 73.519999999999996 110.34 179.189 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.481 ' CB ' ' HG ' ' A' ' 50' ' ' LEU . 16.9 mmt -71.32 -34.81 70.9 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 52.0 110.635 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.2 ttt-85 -63.89 -45.27 90.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.45 0.643 . . . . 63.219999999999999 109.635 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.6 tttp -61.93 -49.09 77.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.541 -1.209 . . . . 61.119999999999997 111.146 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -63.77 -31.07 72.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.703 -0.68 . . . . 60.439999999999998 110.352 177.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.89 32.24 15.41 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.745 -0.661 . . . . 71.129999999999995 112.712 176.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 49' ' ' LYS . 12.5 ptmt -121.98 7.16 9.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.792 0.329 . . . . 61.240000000000002 111.025 -178.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.971 HD21 ' HG2' ' A' ' 41' ' ' GLN . 4.6 mt -60.02 138.81 90.99 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.825 -0.625 . . . . 72.140000000000001 110.656 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 32.3 Cg_exo -61.08 131.86 38.94 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.183 2.588 . . . . 74.319999999999993 112.965 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.411 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 8.0 t30 -72.18 -39.66 68.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.355 -0.838 . . . . 64.310000000000002 111.374 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.691 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 50.7 m-20 -58.29 -53.83 53.83 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.148 0.499 . . . . 64.140000000000001 110.069 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.543 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -59.44 -39.82 84.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.254 -0.884 . . . . 75.030000000000001 110.738 176.345 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 55' ' ' ARG . 11.4 ttt180 -55.85 -50.32 70.92 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.931 -0.577 . . . . 71.209999999999994 110.6 177.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -67.81 -36.24 80.06 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.467 -0.788 . . . . 75.230000000000004 110.548 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 59.4 mt -62.19 -33.59 74.84 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.259 -0.428 . . . . 75.010000000000005 110.822 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 54' ' ' ARG . 56.8 mt -71.47 -41.35 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.138 0.494 . . . . 73.299999999999997 110.377 178.596 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.96 -32.01 73.53 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.132 -0.485 . . . . 72.409999999999997 110.257 177.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -58.87 -47.64 84.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.879 -0.601 . . . . 65.120000000000005 111.668 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.57 HG21 ' HG2' ' A' ' 17' ' ' LYS . 30.2 pt -77.71 -9.72 12.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.839 0.352 . . . . 74.430000000000007 111.488 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.25 14.09 19.39 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.537 -0.839 . . . . 65.5 113.53 174.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -72.57 124.19 24.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.834 -0.432 . . . . 74.430000000000007 109.834 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 115.929 -0.578 . . . . 74.409999999999997 110.831 -176.638 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.485 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 2.9 t-105 . . . . . 0 C--O 1.226 -0.176 0 CA-C-O 120.415 0.15 . . . . 73.209999999999994 111.057 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.459 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.9 tpt -59.18 -41.03 87.5 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.25 0.548 . . . . 32.210000000000001 110.572 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -70.27 -57.86 4.4 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.257 -0.883 . . . . 73.129999999999995 110.791 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -54.38 -32.0 56.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.989 -1.005 . . . . 71.340000000000003 111.241 -179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.659 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 63.8 t80 -58.41 -55.27 37.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.23 -0.441 . . . . 61.240000000000002 110.655 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.788 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 68.2 mm-40 -64.5 -36.73 85.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 64.129999999999995 111.204 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.15 -45.73 83.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.151 -0.477 . . . . 72.340000000000003 110.09 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.22 -40.08 93.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 64.409999999999997 110.95 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.788 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.7 mtpt -52.95 -58.85 5.58 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.931 0.396 . . . . 62.539999999999999 110.438 177.537 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.6 m -62.36 -36.34 81.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.227 -0.897 . . . . 74.239999999999995 111.414 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.672 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 18.9 t80 -63.16 -48.38 78.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 74.340000000000003 110.461 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.573 ' HA ' ' H ' ' A' ' 25' ' ' ARG . 64.6 t -71.8 -38.69 66.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.421 . . . . 52.100000000000001 110.562 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -55.82 -46.4 78.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.698 -0.683 . . . . 70.409999999999997 111.632 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.19 -48.84 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.306 0.484 . . . . 71.299999999999997 112.306 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -100.32 -15.93 17.85 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.026 0.38 . . . . 63.539999999999999 112.026 -170.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.536 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 6.8 mmt180 65.08 95.28 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.678 0.611 . . . . 73.349999999999994 111.519 -175.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.573 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 50.86 -172.74 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.657 1.183 . . . . 65.299999999999997 112.577 178.265 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.672 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 59.8 m-85 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.08 -0.509 . . . . 55.210000000000001 110.78 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 . . . . . 0 C--O 1.233 0.237 0 CA-C-O 121.582 0.706 . . . . 71.319999999999993 109.442 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.442 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 93.5 mt -59.74 -32.87 70.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.858 -1.065 . . . . 74.319999999999993 110.817 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.14 -39.47 97.18 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.019 -0.61 . . . . 75.109999999999999 112.143 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.6 -33.59 47.01 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.179 -0.768 . . . . 63.549999999999997 111.179 178.443 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.801 ' HZ2' ' HD3' ' A' ' 54' ' ' ARG . 38.0 t90 -58.94 -55.17 38.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.159 -0.52 . . . . 74.209999999999994 110.388 175.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.39 -43.0 99.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.257 -0.883 . . . . 60.240000000000002 111.428 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.31 -41.6 63.09 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.914 0.339 . . . . 75.439999999999998 111.914 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.5 m -73.98 -51.19 16.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.145 0.497 . . . . 72.340000000000003 111.407 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.623 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 30.4 mt-30 -85.71 -12.98 49.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.713 1.005 . . . . 73.010000000000005 113.713 -167.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.417 ' HD2' ' C ' ' A' ' 42' ' ' ARG . 6.2 ppt_? -64.59 -24.5 67.62 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.626 0.727 . . . . 75.140000000000001 109.544 173.174 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -78.77 -46.36 19.02 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.093 -0.958 . . . . 74.209999999999994 109.824 176.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.623 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 12.2 mmt -60.69 -31.03 70.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.542 -0.754 . . . . 64.400000000000006 110.512 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.427 ' HB2' HD12 ' A' ' 50' ' ' LEU . 23.5 tpt180 -59.11 -45.75 90.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.469 -0.787 . . . . 63.100000000000001 110.623 174.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.44 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 0.4 OUTLIER -71.33 -43.89 66.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.076 -0.511 . . . . 73.549999999999997 109.651 -179.058 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.437 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 51.7 mt-30 -65.63 -14.32 60.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.608 -0.724 . . . . 74.329999999999998 111.791 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.29 26.53 73.34 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.155 -0.545 . . . . 62.520000000000003 112.444 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.521 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.8 ptmt -110.35 -4.58 15.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.826 0.346 . . . . 52.229999999999997 111.001 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.592 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 3.9 mt -58.9 140.99 86.22 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.835 -0.62 . . . . 75.409999999999997 109.933 174.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 16.7 Cg_exo -69.81 131.26 20.79 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.881 2.387 . . . . 64.430000000000007 112.309 176.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.56 -33.97 72.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.399 -0.819 . . . . 73.540000000000006 111.001 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.721 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 19.1 m-20 -51.91 -53.46 40.64 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.483 0.658 . . . . 75.430000000000007 110.028 176.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.801 ' HD3' ' HZ2' ' A' ' 37' ' ' TRP . 33.1 ttm180 -68.14 -48.65 64.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.742 -1.117 . . . . 73.439999999999998 111.217 -179.248 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.4 ' C ' ' HD3' ' A' ' 55' ' ' ARG . 3.6 tmt_? -50.22 -41.48 50.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.518 -0.765 . . . . 71.040000000000006 110.987 176.588 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.38 -36.14 73.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.559 0.218 . . . . 74.230000000000004 111.119 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 75.6 mt -61.81 -43.14 99.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 44.009999999999998 110.698 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.23 -39.15 86.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.839 -0.619 . . . . 73.409999999999997 111.159 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.94 -28.83 64.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.103 0.478 . . . . 71.120000000000005 110.253 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.46 ' C ' ' HD2' ' A' ' 60' ' ' LYS . 0.4 OUTLIER -66.9 -46.21 75.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.932 -0.576 . . . . 72.400000000000006 110.279 178.922 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.503 HG21 ' HG2' ' A' ' 17' ' ' LYS . 42.6 pt -72.9 -23.07 20.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.551 -0.295 . . . . 73.030000000000001 110.966 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.89 32.4 3.09 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.508 -0.853 . . . . 63.229999999999997 112.933 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -74.79 130.23 39.09 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.031 0.443 . . . . 72.140000000000001 110.29 177.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 C--N 1.323 -0.568 0 CA-C-N 115.684 -0.689 . . . . 65.439999999999998 110.1 179.819 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.512 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.16 0 CA-C-O 120.755 0.312 . . . . 54.0 110.296 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 tpt -55.37 -43.27 74.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 62.530000000000001 110.321 177.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -66.6 -44.22 82.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.182 -0.917 . . . . 62.299999999999997 110.366 -178.773 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -65.64 -33.04 74.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.236 0.541 . . . . 74.239999999999995 110.787 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.431 ' CE2' ' HD2' ' A' ' 17' ' ' LYS . 91.5 t80 -63.99 -53.48 49.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 73.519999999999996 110.901 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -63.16 -32.27 73.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.273 -0.421 . . . . 74.450000000000003 111.336 -176.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 47.7 mt-10 -63.69 -42.4 97.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.821 0.343 . . . . 74.129999999999995 110.979 177.269 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.467 HD23 ' O ' ' A' ' 16' ' ' LEU . 4.4 tt -79.51 -36.19 38.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.898 -0.778 . . . . 64.420000000000002 108.898 -174.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.431 ' HD2' ' CE2' ' A' ' 13' ' ' TYR . 61.1 tttm -53.75 -44.79 70.28 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.694 -1.139 . . . . 72.530000000000001 110.879 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 58.4 m -82.25 -32.95 29.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.851 -0.613 . . . . 71.010000000000005 111.33 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -64.83 -47.25 78.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.819 0.342 . . . . 71.010000000000005 110.921 -177.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.521 HG11 HD12 ' A' ' 61' ' ' ILE . 8.7 p -65.61 -33.77 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.274 -0.421 . . . . 72.310000000000002 110.511 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.76 -25.27 62.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.234 0.54 . . . . 61.329999999999998 109.9 179.564 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -93.17 -56.07 3.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.612 -0.722 . . . . 65.409999999999997 111.553 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -90.54 -15.93 29.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.159 -0.473 . . . . 75.510000000000005 111.567 -174.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 9.6 mmm180 58.34 88.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.878 0.736 . . . . 71.5 110.556 -174.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.518 ' HG2' ' N ' ' A' ' 26' ' ' PHE . 37.8 ttt-85 67.24 167.34 0.24 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.698 -1.137 . . . . 72.310000000000002 111.117 -176.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.518 ' N ' ' HG2' ' A' ' 25' ' ' ARG . 52.7 m-85 . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 109.075 -0.713 . . . . 74.340000000000003 109.075 174.111 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.845 0.355 . . . . 60.020000000000003 110.784 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.474 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 82.4 mt -66.73 -30.94 71.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 72.349999999999994 110.803 176.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.54 -36.66 91.76 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.793 -0.923 . . . . 64.400000000000006 110.793 174.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.21 -38.12 63.26 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.173 -0.771 . . . . 70.030000000000001 111.173 174.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -56.27 -49.24 74.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.907 -0.405 . . . . 75.230000000000004 109.907 174.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.76 -51.26 70.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.622 -0.717 . . . . 72.140000000000001 110.635 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -56.71 -46.85 81.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 74.219999999999999 111.232 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.567 ' O ' ' HG2' ' A' ' 44' ' ' MET . 51.7 m -61.84 -42.58 99.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.222 -0.445 . . . . 72.129999999999995 110.926 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.78 -27.05 68.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 51.439999999999998 111.744 -175.006 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 42' ' ' ARG . 1.2 tmt_? -58.77 -36.99 75.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 71.400000000000006 110.217 177.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.438 ' CE ' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -84.07 -34.78 24.13 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.932 -0.307 . . . . 74.549999999999997 110.501 178.131 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.567 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.3 mmt -55.16 -38.94 68.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.269 -0.423 . . . . 74.209999999999994 111.413 -176.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.525 ' HB3' HD12 ' A' ' 50' ' ' LEU . 10.9 ptm180 -72.33 -34.5 68.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.728 0.299 . . . . 74.230000000000004 111.021 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.77 -30.41 59.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.231 -0.655 . . . . 73.319999999999993 109.231 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -77.25 -16.99 58.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.392 -0.822 . . . . 51.329999999999998 110.462 174.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 74.24 24.44 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.965 -0.561 . . . . 74.25 112.642 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' A' ' 49' ' ' LYS . 19.3 ptmt -109.13 -3.04 17.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.646 0.26 . . . . 54.020000000000003 111.455 -177.102 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.875 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -64.65 139.07 97.66 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.644 -0.502 . . . . 62.229999999999997 109.644 176.774 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.875 ' HD2' HD23 ' A' ' 50' ' ' LEU . 2.6 Cg_exo -78.56 124.22 6.28 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.678 2.252 . . . . 74.25 111.753 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -61.06 -31.14 70.8 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.612 -0.722 . . . . 41.009999999999998 109.835 175.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.727 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.2 m-20 -57.56 -52.39 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.495 -0.775 . . . . 65.230000000000004 109.671 174.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HG3' ' CH2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -67.42 -31.88 72.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 74.420000000000002 110.119 -178.866 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -60.9 -43.91 97.88 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.307 -0.627 . . . . 72.420000000000002 109.307 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 65.8 tp -72.48 -41.91 65.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.0 -0.546 . . . . 73.519999999999996 110.508 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 79.1 mt -58.03 -43.31 86.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.845 0.355 . . . . 73.439999999999998 110.466 177.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.676 HD12 HD11 ' A' ' 61' ' ' ILE . 21.2 tp -64.77 -44.56 89.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.675 -0.693 . . . . 53.240000000000002 110.403 -178.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -63.19 -38.01 89.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.156 -0.475 . . . . 72.5 110.322 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -70.84 -36.55 72.95 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.906 -0.588 . . . . 75.319999999999993 111.997 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.676 HD11 HD12 ' A' ' 58' ' ' LEU . 10.7 pt -74.56 -3.66 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.758 0.313 . . . . 54.530000000000001 111.75 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.6 20.06 8.37 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.311 -0.947 . . . . 43.520000000000003 113.497 173.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -87.54 119.72 28.11 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.199 0.523 . . . . 73.209999999999994 110.559 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.483 ' CG1' ' HD2' ' A' ' 25' ' ' ARG . 14.4 p . . . . . 0 N--CA 1.442 -0.836 0 CA-C-N 115.473 -0.785 . . . . 42.210000000000001 110.293 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 7.3 t-105 . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.398 0.142 . . . . 70.510000000000005 111.199 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.459 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -59.84 -31.2 69.52 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.119 0.485 . . . . 52.5 110.381 -179.193 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.68 -48.24 15.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.924 -0.58 . . . . 73.150000000000006 110.058 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -65.28 -32.89 74.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 116.326 -0.397 . . . . 73.329999999999998 111.792 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -65.77 -53.31 42.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.822 0.344 . . . . 73.439999999999998 110.195 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.738 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 65.3 mm-40 -61.21 -31.98 71.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.302 0.572 . . . . 74.25 110.032 176.347 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.21 -52.24 63.06 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.081 -0.963 . . . . 74.540000000000006 110.095 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.4 tp -61.04 -44.72 96.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.725 -0.671 . . . . 70.209999999999994 111.133 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.738 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.9 mtpt -51.49 -58.42 6.32 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.501 0.667 . . . . 54.329999999999998 109.881 176.284 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.9 m -61.79 -42.53 99.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.562 -1.199 . . . . 73.140000000000001 111.838 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.473 ' CE2' ' HB3' ' A' ' 26' ' ' PHE . 26.4 t80 -67.18 -46.59 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.63 0.252 . . . . 64.049999999999997 110.799 -176.167 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 t -66.46 -39.38 83.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.957 -0.297 . . . . 73.340000000000003 110.678 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -60.94 -25.71 66.98 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.007 0.432 . . . . 71.530000000000001 110.203 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -92.77 -58.34 2.38 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.257 -0.429 . . . . 75.109999999999999 112.141 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -100.81 -30.04 11.92 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.207 0.447 . . . . 44.219999999999999 112.207 -170.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.3 OUTLIER 64.27 94.65 0.05 Allowed 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 123.846 0.716 . . . . 71.340000000000003 110.461 -168.379 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.2 mmm180 75.61 168.31 0.27 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 114.316 -1.311 . . . . 73.019999999999996 111.185 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.546 ' CZ ' ' HB3' ' A' ' 34' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.322 -0.594 0 CA-C-N 115.523 -0.762 . . . . 75.409999999999997 110.067 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 120.931 0.396 . . . . 71.430000000000007 111.183 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 26' ' ' PHE . 3.6 mm? -74.37 -26.68 60.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.143 -0.48 . . . . 75.109999999999999 110.709 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.88 97.74 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.61 -0.596 . . . . 70.25 111.61 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.57 -35.62 75.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.866 -0.683 . . . . 73.230000000000004 111.479 176.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -60.04 -49.81 76.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 74.209999999999994 109.946 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.1 m -70.33 -33.23 71.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.739 -0.664 . . . . 75.340000000000003 111.928 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -53.42 -37.08 62.21 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.799 0.333 . . . . 73.340000000000003 111.309 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 39.7 m -77.95 -44.55 26.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.893 -0.594 . . . . 62.420000000000002 111.369 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 27.8 mt-30 -84.84 -19.23 32.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.43 0.9 . . . . 61.409999999999997 113.43 -170.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.65 -26.75 68.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.126 0.489 . . . . 73.030000000000001 109.936 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -70.55 -45.48 65.39 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.526 -0.761 . . . . 65.219999999999999 109.631 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.791 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.5 mmt -65.94 -33.51 75.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.766 -0.652 . . . . 73.310000000000002 110.774 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.649 ' HB2' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -68.43 -47.05 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 73.510000000000005 110.082 178.76 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.406 ' HD2' ' O ' ' A' ' 46' ' ' LYS . 0.3 OUTLIER -63.54 -45.65 89.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.784 -0.643 . . . . 75.099999999999994 109.444 179.819 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.488 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 1.2 tp-100 -67.6 -31.01 70.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 72.540000000000006 110.909 -178.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.84 41.24 4.73 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.206 -0.521 . . . . 75.400000000000006 113.385 174.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HE2' ' HB3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -131.96 2.62 4.01 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 117.212 0.506 . . . . 64.030000000000001 111.455 177.654 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.791 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 5.1 mt -54.24 140.0 54.96 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.721 -0.392 . . . . 71.510000000000005 110.434 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.6 140.52 81.7 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 123.262 2.641 . . . . 73.439999999999998 113.002 178.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.485 ' O ' ' HG3' ' A' ' 55' ' ' ARG . 18.1 m120 -64.3 -29.05 70.15 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.057 -0.974 . . . . 74.329999999999998 110.754 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -70.26 -44.27 68.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.066 0.46 . . . . 74.019999999999996 109.828 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' A' ' 54' ' ' ARG . 26.5 mmt180 -59.17 -51.8 68.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 71.25 110.987 177.314 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -66.02 -27.58 68.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.314 -0.403 . . . . 74.329999999999998 110.452 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.32 -44.2 30.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.711 0.291 . . . . 72.409999999999997 110.503 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.1 tp -59.46 -45.89 90.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.977 -0.556 . . . . 71.219999999999999 110.822 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.532 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 10.5 mp -66.05 -45.0 82.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.903 -0.589 . . . . 50.420000000000002 110.472 178.425 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.12 -28.25 69.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.287 0.565 . . . . 65.430000000000007 110.56 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -53.55 19.3 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 115.792 -0.64 . . . . 54.140000000000001 110.959 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.0 pt -68.49 -19.86 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.682 0.277 . . . . 40.25 111.728 -176.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.98 22.72 4.14 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.591 -0.814 . . . . 65.239999999999995 112.601 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.532 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 45.3 t80 -83.78 103.7 13.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.416 0.627 . . . . 70.209999999999994 109.723 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.444 -0.771 0 CA-C-N 115.059 -0.973 . . . . 73.25 110.044 -179.811 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.563 ' HZ3' ' HZ2' ' A' ' 37' ' ' TRP . 25.6 t-105 . . . . . 0 N--CA 1.461 0.114 0 N-CA-C 112.584 0.587 . . . . 74.219999999999999 112.584 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.514 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.4 tpt -53.69 -39.03 64.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.235 0.54 . . . . 74.319999999999993 110.63 -177.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HE2' ' HB3' ' A' ' 11' ' ' LYS . 4.5 tmmm? -75.42 -41.93 54.76 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.637 -0.71 . . . . 72.439999999999998 110.199 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -59.0 -38.8 80.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.831 -0.622 . . . . 65.219999999999999 111.092 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -60.93 -48.18 83.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 74.450000000000003 110.371 177.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.664 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 70.6 mm-40 -64.68 -38.97 92.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 71.140000000000001 110.697 178.201 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -60.28 -45.2 94.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.887 -0.597 . . . . 72.329999999999998 109.692 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.5 ' HA ' HD11 ' A' ' 34' ' ' LEU . 33.0 tp -58.95 -47.34 85.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 72.310000000000002 110.946 178.188 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.664 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.3 mtpt -54.99 -55.73 27.65 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.22 0.533 . . . . 71.530000000000001 110.765 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.8 t -55.74 -47.26 77.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.204 -0.907 . . . . 52.100000000000001 111.069 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.56 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 42.2 t80 -65.26 -46.78 79.13 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.274 -0.421 . . . . 74.109999999999999 111.292 -176.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.556 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 9.4 p -68.09 -32.56 56.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-N 116.311 -0.404 . . . . 62.43 110.896 -178.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.482 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.6 tmt_? -70.94 -19.08 62.61 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.199 0.524 . . . . 74.030000000000001 110.179 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -85.16 -61.51 1.75 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.939 -0.573 . . . . 65.519999999999996 111.445 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -97.13 -19.0 18.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.767 0.318 . . . . 73.129999999999995 110.777 -176.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.556 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER 60.81 93.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 65.340000000000003 110.546 -168.36 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.516 ' H ' HG23 ' A' ' 20' ' ' VAL . 63.0 ttt180 65.21 158.64 0.1 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.445 -1.252 . . . . 73.109999999999999 112.184 -172.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.56 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 11.2 p90 . . . . . 0 C--N 1.317 -0.829 0 CA-C-N 114.583 -1.19 . . . . 75.219999999999999 109.387 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.1 m120 . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.081 0.467 . . . . 51.329999999999998 111.055 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.5 HD11 ' HA ' ' A' ' 16' ' ' LEU . 3.1 mm? -75.13 -24.9 58.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.947 -0.569 . . . . 51.009999999999998 110.26 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.49 -36.16 92.77 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.658 -0.701 . . . . 34.130000000000003 112.022 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.42 -36.45 49.66 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.564 -0.827 . . . . 61.030000000000001 111.661 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.563 ' HZ2' ' HZ3' ' A' ' 9' ' ' TRP . 3.7 m95 -58.91 -49.88 76.14 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.032 0.444 . . . . 71.010000000000005 110.596 175.674 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -61.18 -40.21 93.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.314 -0.857 . . . . 73.310000000000002 111.174 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -69.8 -46.66 65.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.144 0.424 . . . . 61.240000000000002 112.144 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.467 ' O ' ' HG2' ' A' ' 44' ' ' MET . 49.0 m -80.99 -57.52 3.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.429 0.529 . . . . 35.310000000000002 112.429 -172.188 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.13 -18.46 49.75 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.535 0.939 . . . . 73.349999999999994 113.535 -166.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 42' ' ' ARG . 5.4 tmm_? -65.23 -32.12 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.194 0.521 . . . . 64.310000000000002 109.821 176.399 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.0 ttmm -76.51 -46.05 28.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.734 -0.666 . . . . 54.310000000000002 110.551 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.542 ' HB3' ' HG3' ' A' ' 49' ' ' LYS . 11.6 mmt -59.92 -28.75 67.87 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.54 -0.755 . . . . 71.340000000000003 111.273 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 ttt180 -64.88 -48.94 72.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.032 0.444 . . . . 73.140000000000001 110.463 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.502 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 3.3 tmmm? -65.76 -34.7 78.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.354 0.597 . . . . 54.350000000000001 109.619 -179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -83.74 1.03 44.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.518 -0.764 . . . . 63.140000000000001 111.704 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 59.25 34.45 80.15 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 116.356 -0.384 . . . . 72.019999999999996 113.232 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 17.9 ptmt -119.21 1.9 11.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.161 0.505 . . . . 70.420000000000002 110.967 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 mt -61.77 142.22 94.83 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.325 -0.852 . . . . 61.43 110.113 172.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.529 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 26.0 Cg_exo -64.65 120.69 8.03 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.177 1.918 . . . . 75.010000000000005 111.038 169.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -56.58 -32.86 65.63 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.98 -0.555 . . . . 73.310000000000002 110.42 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -58.31 -41.3 84.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 61.329999999999998 110.57 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.529 ' HG2' ' HB2' ' A' ' 51' ' ' PRO . 18.7 mmt180 -62.1 -50.2 72.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 116.088 -0.506 . . . . 74.439999999999998 110.799 179.549 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -54.24 -37.81 65.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.778 -0.646 . . . . 72.349999999999994 110.521 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 tt -68.38 -53.1 26.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 74.420000000000002 110.366 178.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mp -60.71 -39.39 88.38 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.336 -0.393 . . . . 74.430000000000007 111.592 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.59 HD13 HD11 ' A' ' 61' ' ' ILE . 4.0 mm? -61.66 -40.09 93.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.996 0.427 . . . . 62.420000000000002 110.787 178.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -66.7 -35.74 80.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.278 -0.419 . . . . 72.329999999999998 110.595 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -64.51 -42.55 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 75.140000000000001 111.255 -178.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.59 HD11 HD13 ' A' ' 58' ' ' LEU . 6.8 pt -77.76 -17.05 14.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.741 0.305 . . . . 75.349999999999994 111.682 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 117.4 29.75 2.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.08 -1.057 . . . . 50.200000000000003 113.949 172.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -84.57 106.9 16.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.532 -0.544 . . . . 72.120000000000005 109.532 175.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 12.9 p . . . . . 0 C--N 1.322 -0.622 0 CA-C-N 115.626 -0.715 . . . . 61.450000000000003 110.892 -177.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.669 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 120.43 0.157 . . . . 75.549999999999997 110.844 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -38.01 85.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 72.030000000000001 109.705 175.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.434 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 25.1 ttmt -70.14 -49.42 50.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.493 -0.776 . . . . 55.020000000000003 110.097 174.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.462 ' HB2' ' HA ' ' A' ' 9' ' ' TRP . 74.1 m-20 -54.61 -46.4 73.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.19 -0.913 . . . . 75.25 111.511 -178.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.423 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 32.4 t80 -55.65 -48.0 75.71 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.923 -0.581 . . . . 61.450000000000003 112.039 -173.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 11' ' ' LYS . 17.1 pt-20 -68.78 -34.85 76.25 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.96 -0.296 . . . . 72.019999999999996 111.259 -175.381 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -76.03 -40.91 52.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.033 0.444 . . . . 75.310000000000002 110.121 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.571 HD21 ' CD2' ' A' ' 58' ' ' LEU . 38.2 tp -57.04 -54.17 49.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 55.119999999999997 111.723 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 13' ' ' TYR . 8.4 mtpm? -51.79 -52.47 48.76 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.426 0.631 . . . . 70.310000000000002 110.556 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.9 m -58.9 -44.62 91.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.506 -1.225 . . . . 62.219999999999999 111.597 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.685 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 7.8 t80 -67.41 -52.42 40.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 74.530000000000001 110.422 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.435 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 78.1 t -60.1 -33.91 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.426 . . . . 75.530000000000001 111.621 178.409 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 21' ' ' ARG . 1.6 tmt_? -61.41 -26.84 68.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.377 -0.374 . . . . 75.329999999999998 111.106 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -108.94 -52.8 2.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.458 -0.337 . . . . 73.310000000000002 111.379 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 88.4 m-85 -90.7 -15.61 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.749 0.278 . . . . 64.349999999999994 111.749 -174.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.515 ' O ' ' HA ' ' A' ' 63' ' ' PHE . 26.6 mmt180 75.06 -18.46 0.44 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.632 0.773 . . . . 74.420000000000002 112.861 -178.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 177.16 174.0 0.45 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.858 -0.423 . . . . 74.400000000000006 109.858 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.685 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 7.7 p90 . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 71.439999999999998 111.363 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t30 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.112 -0.699 . . . . 72.530000000000001 109.112 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.2 mt -63.64 -43.88 95.5 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.441 -0.8 . . . . 71.329999999999998 110.934 177.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -51.82 -42.5 53.24 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 120.838 -0.696 . . . . 31.41 112.743 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.94 -34.49 27.03 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.313 -0.946 . . . . 43.530000000000001 112.261 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.504 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 17.2 t90 -57.17 -49.26 76.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.983 -0.377 . . . . 75.120000000000005 109.983 177.191 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.664 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 42.3 t -58.34 -50.72 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.919 -0.582 . . . . 74.510000000000005 110.63 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -61.62 -37.51 84.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.929 -0.578 . . . . 74.530000000000001 112.257 -176.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 m -82.78 -36.28 25.79 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.902 0.382 . . . . 65.109999999999999 111.405 -177.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.799 ' HG3' HD21 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.58 -18.29 61.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 73.099999999999994 111.581 -176.447 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 38' ' ' CYS . 18.0 mmt180 -52.78 -47.63 67.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.354 0.597 . . . . 71.409999999999997 109.954 173.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 47' ' ' GLN . 1.2 tmmm? -70.29 -42.12 72.46 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.074 -0.967 . . . . 71.140000000000001 110.827 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.659 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.5 mmt -64.11 -35.85 82.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.233 0.54 . . . . 72.420000000000002 110.651 -177.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.595 ' CB ' HD12 ' A' ' 50' ' ' LEU . 2.2 tmm_? -69.42 -49.66 53.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.334 -0.848 . . . . 70.150000000000006 110.17 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.02 -31.58 68.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.157 -0.474 . . . . 63.509999999999998 110.646 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.524 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 20.0 tp60 -72.74 -22.12 60.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.525 . . . . 61.210000000000001 110.575 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.42 37.52 27.39 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.728 -0.749 . . . . 64.439999999999998 111.98 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.524 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 19.2 ptmt -121.06 -1.3 9.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.189 0.519 . . . . 74.319999999999993 110.917 177.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.799 HD21 ' HG3' ' A' ' 41' ' ' GLN . 7.0 mt -68.97 142.58 93.5 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.768 -0.651 . . . . 64.430000000000007 110.09 172.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -73.67 138.32 26.35 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.0 2.466 . . . . 74.319999999999993 111.54 174.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -72.37 -34.8 68.22 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.161 -0.927 . . . . 75.109999999999999 112.457 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.628 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 36.0 m-20 -54.76 -51.86 64.38 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.872 0.367 . . . . 73.349999999999994 110.546 -177.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.669 ' HG3' ' CZ2' ' A' ' 9' ' ' TRP . 2.8 ttp85 -55.58 -38.88 69.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 70.510000000000005 111.301 177.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -59.8 -43.76 94.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.051 0.453 . . . . 72.409999999999997 110.539 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.33 -33.32 63.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.9 -0.591 . . . . 74.549999999999997 110.654 -177.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.2 mt -60.96 -36.45 79.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 72.5 110.633 177.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 54' ' ' ARG . 23.9 mt -63.61 -37.9 89.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 75.120000000000005 110.241 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.27 -25.91 68.26 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.942 -0.572 . . . . 73.400000000000006 111.187 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -36.19 56.06 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.405 -0.362 . . . . 73.409999999999997 110.932 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.4 pt -81.53 -12.22 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.82 0.343 . . . . 64.219999999999999 111.189 177.213 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.85 18.97 10.02 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.585 -0.817 . . . . 64.230000000000004 113.073 176.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.549 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 42.6 t80 -76.63 107.17 8.73 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.001 -0.74 . . . . 74.120000000000005 109.001 176.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.442 -0.866 0 CA-C-N 115.346 -0.843 . . . . 75.349999999999994 111.224 -175.36 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.478 0.974 0 CA-C-O 120.82 0.343 . . . . 74.329999999999998 110.361 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -114.58 -163.2 0.86 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.738 -0.467 . . . . 75.209999999999994 109.738 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -64.0 -46.7 83.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.793 -0.185 . . . . 71.209999999999994 110.698 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 59.98 -164.21 0.22 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.15 -0.477 . . . . 72.329999999999998 109.823 -177.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 74.7 mt -102.38 5.95 40.02 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.458 0.647 . . . . 73.430000000000007 109.478 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -97.92 37.77 1.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.155 -0.93 . . . . 63.109999999999999 111.171 -174.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -62.1 -37.73 94.95 Favored Glycine 0 N--CA 1.454 -0.15 0 C-N-CA 120.954 -0.641 . . . . 74.450000000000003 111.926 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -57.46 -48.85 78.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.79 0.328 . . . . 62.420000000000002 110.459 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.528 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 8.3 t-105 -56.01 -50.11 71.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.786 -0.643 . . . . 75.430000000000007 110.538 177.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.425 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.7 tpt -56.64 -45.54 81.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.136 -0.483 . . . . 73.219999999999999 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmpt? -68.36 -45.21 73.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 73.340000000000003 110.798 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -69.62 -35.92 75.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.342 -0.39 . . . . 73.129999999999995 111.397 -177.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.44 ' CE1' ' HB3' ' A' ' 57' ' ' LEU . 44.4 t80 -59.29 -50.97 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.779 -0.191 . . . . 75.530000000000001 111.088 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.82 -25.05 64.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.817 0.342 . . . . 73.219999999999999 111.176 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.487 ' OE2' ' HG ' ' A' ' 34' ' ' LEU . 34.8 tt0 -72.18 -41.12 67.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 62.219999999999999 110.107 177.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.538 HD12 HD22 ' A' ' 34' ' ' LEU . 7.1 tt -79.94 -31.51 40.05 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.878 -0.786 . . . . 65.450000000000003 108.878 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.692 ' HA ' HD12 ' A' ' 61' ' ' ILE . 85.4 tttt -55.68 -49.78 72.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.194 . . . . 74.430000000000007 110.371 174.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 m -72.75 -31.08 64.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.44 -0.8 . . . . 72.219999999999999 110.793 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.631 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 29.3 t80 -70.81 -46.99 61.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 71.109999999999999 110.377 -178.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.914 HG22 ' H ' ' A' ' 25' ' ' ARG . 24.2 t -65.2 -34.27 69.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.358 -0.383 . . . . 65.109999999999999 111.688 177.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -58.5 -20.94 50.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.292 0.568 . . . . 72.109999999999999 109.983 175.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -100.48 -47.75 4.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.024 -0.535 . . . . 61.32 111.646 -176.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -111.49 -25.92 9.34 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.378 0.881 . . . . 74.329999999999998 113.378 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.872 ' HA ' HG13 ' A' ' 20' ' ' VAL . 3.0 mpt_? 60.21 92.03 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.908 -0.405 . . . . 70.319999999999993 109.908 -166.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.914 ' H ' HG22 ' A' ' 20' ' ' VAL . 33.3 ttt180 67.59 161.64 0.18 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.75 0.786 . . . . 65.439999999999998 111.548 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.631 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 5.7 p90 -130.0 87.25 52.2 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 62.409999999999997 110.513 -179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.19 -20.51 62.77 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 123.097 2.531 . . . . 73.420000000000002 113.001 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -87.38 -49.9 6.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.464 -0.335 . . . . 62.520000000000003 110.269 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.499 ' OG ' ' HA2' ' A' ' 35' ' ' GLY . 7.8 t 65.38 81.79 0.2 Allowed 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.461 -0.791 . . . . 63.100000000000001 111.002 177.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.4 p -139.06 17.5 2.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.799 -0.637 . . . . 64.519999999999996 110.885 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.562 ' H ' ' CD ' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -98.31 14.45 27.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.169 -0.468 . . . . 61.409999999999997 111.897 -173.848 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.59 -83.41 0.79 Allowed Glycine 0 CA--C 1.518 0.245 0 C-N-CA 121.013 -0.613 . . . . 43.100000000000001 113.893 173.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -65.04 -55.57 18.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.607 0.242 . . . . 65.239999999999995 111.269 -172.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.538 HD22 HD12 ' A' ' 16' ' ' LEU . 77.7 mt -66.96 -34.26 77.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.847 0.356 . . . . 73.530000000000001 110.141 178.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.499 ' HA2' ' OG ' ' A' ' 29' ' ' SER . . . -59.29 -43.15 97.49 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 53.049999999999997 112.181 178.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.36 -39.15 57.77 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.839 -0.696 . . . . 63.119999999999997 111.417 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.492 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 6.3 t90 -60.15 -42.53 95.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.91 0.386 . . . . 73.530000000000001 110.444 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.5 t -66.14 -38.83 89.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 72.519999999999996 110.888 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.6 m80 -59.25 -47.86 83.79 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 73.140000000000001 110.64 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.49 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 9.2 m -67.22 -35.1 78.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.204 0.526 . . . . 72.120000000000005 110.571 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.492 ' HB2' ' O ' ' A' ' 37' ' ' TRP . 3.2 tp-100 -65.12 -28.37 69.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.567 -0.742 . . . . 74.310000000000002 111.675 -174.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -54.77 -46.5 74.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 75.310000000000002 110.939 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.558 ' HD3' ' H ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -74.04 -22.53 59.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.062 -0.517 . . . . 73.409999999999997 110.717 -176.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.491 ' CB ' ' HG ' ' A' ' 50' ' ' LEU . 25.7 mmt -67.09 -46.25 74.83 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.412 -0.588 . . . . 73.319999999999993 109.412 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.519 ' HB2' HD12 ' A' ' 50' ' ' LEU . 8.1 tmm_? -75.48 -35.68 60.8 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.272 -0.876 . . . . 74.510000000000005 109.819 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.512 ' HB3' ' HA ' ' A' ' 43' ' ' LYS . 1.7 tmtp? -61.0 -47.3 87.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.88 -0.6 . . . . 73.219999999999999 110.706 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.5 tt0 -75.4 -31.86 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.142 -0.481 . . . . 74.310000000000002 110.873 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.36 21.65 37.31 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.825 -0.702 . . . . 52.539999999999999 111.85 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.436 ' HD3' ' SD ' ' A' ' 44' ' ' MET . 13.8 ptmt -95.96 -5.1 42.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.095 0.474 . . . . 72.219999999999999 109.763 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' ' 45' ' ' ARG . 1.3 mt -57.43 138.95 81.03 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.047 -0.979 . . . . 63.450000000000003 110.163 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 3.5 Cg_exo -82.46 128.09 5.32 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.115 2.543 . . . . 71.5 111.191 174.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -61.13 -28.54 69.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.817 -0.629 . . . . 53.340000000000003 111.806 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -66.87 -46.11 76.0 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.071 0.463 . . . . 60.130000000000003 109.973 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.528 ' HG2' ' CH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -62.44 -41.57 98.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.005 -0.739 . . . . 73.109999999999999 109.005 176.267 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.582 ' HG2' ' CZ2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -62.0 -44.62 96.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.103 -0.953 . . . . 72.239999999999995 110.646 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.64 -41.99 74.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 52.210000000000001 111.724 -177.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.44 ' HB3' ' CE1' ' A' ' 13' ' ' TYR . 5.9 mp -57.87 -43.07 85.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.709 0.262 . . . . 55.43 111.709 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.513 HD22 ' NH2' ' A' ' 54' ' ' ARG . 9.3 mp -71.6 -33.38 68.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 65.150000000000006 111.095 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.92 -38.37 90.73 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.225 0.535 . . . . 51.530000000000001 110.014 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -69.86 -29.99 67.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.173 -0.921 . . . . 75.540000000000006 112.128 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.692 HD12 ' HA ' ' A' ' 17' ' ' LYS . 26.2 pt -84.61 -8.47 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.592 -0.443 . . . . 74.25 110.917 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.06 18.44 9.89 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.701 -0.761 . . . . 65.140000000000001 113.467 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -79.44 104.66 10.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.526 0.679 . . . . 70.120000000000005 109.732 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.447 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 13.0 p -80.43 136.69 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 114.945 -1.025 . . . . 74.140000000000001 110.881 -177.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.582 ' CZ2' ' HG2' ' A' ' 55' ' ' ARG . 76.5 m95 -89.32 -29.01 19.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.948 -0.569 . . . . 75.109999999999999 109.98 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.3 m 65.18 -179.47 0.18 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.203 -0.908 . . . . 53.539999999999999 111.139 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.5 mt -110.5 83.49 1.77 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.384 0.611 . . . . 63.340000000000003 109.618 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -82.37 -38.68 23.82 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.884 -1.053 . . . . 61.210000000000001 109.346 -177.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -93.39 95.66 9.44 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.029 -0.987 . . . . 72.239999999999995 109.206 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -77.21 87.91 3.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.025 -0.534 . . . . 64.230000000000004 110.446 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -172.32 88.29 0.09 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.418 -0.81 . . . . 74.120000000000005 109.366 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -96.14 126.72 41.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.017 0.437 . . . . 74.299999999999997 110.213 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -87.38 -6.95 58.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.504 0.669 . . . . 63.32 109.255 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 53.0 t60 . . . . . 0 C--O 1.243 0.726 0 N-CA-C 108.288 -1.004 . . . . 73.510000000000005 108.288 175.333 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 109.774 -0.454 . . . . 75.540000000000006 109.774 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -152.7 37.7 0.52 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.035 -0.53 . . . . 63.210000000000001 109.744 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -59.42 104.46 0.27 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.765 -0.652 . . . . 61.5 111.186 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -88.64 173.11 8.8 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.828 -0.624 . . . . 72.230000000000004 111.113 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -96.22 76.81 3.03 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.341 -0.985 . . . . 64.439999999999998 108.341 170.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.403 ' C ' ' H ' ' A' ' 8' ' ' GLU . 56.1 tp60 -111.73 147.81 34.81 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.409 -0.814 . . . . 75.219999999999999 109.919 -174.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.0 29.81 1.84 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.098 -0.573 . . . . 44.229999999999997 112.157 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.403 ' H ' ' C ' ' A' ' 6' ' ' GLN . 6.3 tp10 -70.85 -13.47 62.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.876 -0.416 . . . . 51.32 109.876 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -62.95 -48.09 80.4 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.64 -0.504 . . . . 74.439999999999998 109.64 172.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.502 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 8.0 mmt -61.16 -40.34 93.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.067 0.46 . . . . 72.530000000000001 109.783 176.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -49.81 75.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.35 -0.841 . . . . 74.239999999999995 110.067 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.411 HD21 ' HB3' ' A' ' 33' ' ' ASN . 10.4 m-80 -57.04 -44.23 82.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.097 -0.501 . . . . 52.119999999999997 110.835 177.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.635 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 56.3 t80 -61.36 -52.25 65.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.849 -0.614 . . . . 74.030000000000001 110.578 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.824 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 50.7 mm-40 -61.62 -37.54 84.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.763 0.316 . . . . 62.420000000000002 110.797 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -65.27 -42.34 93.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.272 -0.422 . . . . 64.239999999999995 110.105 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 tp -68.05 -37.31 81.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.913 -0.585 . . . . 62.229999999999997 110.82 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.824 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 59.2 mtpt -55.42 -49.87 71.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.486 0.66 . . . . 73.030000000000001 109.408 172.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 21.3 t -59.72 -40.84 89.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.34 -1.3 . . . . 74.530000000000001 110.739 176.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.27 -37.72 88.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 120.904 0.383 . . . . 73.540000000000006 110.728 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.612 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 21.3 t -71.76 -40.64 69.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.785 0.661 . . . . 71.530000000000001 112.785 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -65.29 -17.0 64.15 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 119.826 -0.75 . . . . 73.129999999999995 110.439 178.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.442 ' HG3' ' HD3' ' A' ' 21' ' ' ARG . 85.6 mttt -97.76 -64.48 1.04 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.957 -0.565 . . . . 71.5 111.654 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -110.62 -5.9 14.96 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 73.329999999999998 111.938 -172.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.612 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 4.3 mpt_? 63.67 12.8 6.85 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.893 0.477 . . . . 53.310000000000002 110.759 -177.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 39.6 ttt180 -170.38 168.78 7.82 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.744 -0.836 . . . . 73.150000000000006 108.744 -171.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.643 ' HE2' ' HB2' ' A' ' 38' ' ' CYS . 8.3 p90 -120.88 85.21 39.62 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-O 121.505 0.669 . . . . 71.219999999999999 109.89 174.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.39 -32.82 6.04 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.487 2.125 . . . . 54.020000000000003 111.817 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -129.04 105.45 8.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.713 -0.676 . . . . 74.349999999999994 109.532 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.1 m -73.58 99.19 2.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.165 -0.47 . . . . 70.319999999999993 110.6 -178.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.42 -39.21 93.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.167 -0.469 . . . . 74.329999999999998 111.325 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -98.19 153.44 18.47 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.256 -0.429 . . . . 63.030000000000001 110.717 -178.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.61 -20.13 69.72 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.758 -0.937 . . . . 54.229999999999997 110.758 173.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.411 ' HB3' HD21 ' A' ' 12' ' ' ASN . 77.3 m-20 -63.8 -55.93 19.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.29 -0.455 . . . . 73.209999999999994 110.524 176.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.628 ' HA ' ' HB2' ' A' ' 37' ' ' TRP . 94.1 mt -71.95 -27.35 62.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.054 -0.521 . . . . 71.239999999999995 110.408 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.6 -43.72 98.9 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 110.604 -0.999 . . . . 74.349999999999994 110.604 173.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.23 -28.91 61.14 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.025 -0.607 . . . . 63.100000000000001 111.606 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.628 ' HB2' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.94 -50.52 70.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.371 0.605 . . . . 64.219999999999999 109.52 174.07 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.643 ' HB2' ' HE2' ' A' ' 26' ' ' PHE . 48.6 t -64.73 -40.48 95.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.177 -0.92 . . . . 73.239999999999995 111.049 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 44.7 m170 -72.02 -54.72 9.04 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.943 0.349 . . . . 74.230000000000004 111.943 -175.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.1 m -63.99 -40.43 96.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.079 0.466 . . . . 75.019999999999996 111.148 -174.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.718 ' HG2' HD21 ' A' ' 50' ' ' LEU . 9.9 mt-30 -84.13 -11.24 56.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.105 -0.498 . . . . 43.539999999999999 111.686 -177.039 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.607 ' HB2' ' O ' ' A' ' 38' ' ' CYS . 6.1 tpt180 -62.45 -36.25 81.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.932 0.873 . . . . 74.319999999999993 109.291 174.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.421 ' HE3' ' NE2' ' A' ' 47' ' ' GLN . 71.6 tttt -73.63 -54.36 8.33 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.405 -1.27 . . . . 75.25 111.134 178.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.484 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.4 mmt -57.62 -38.42 74.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.996 -0.547 . . . . 71.230000000000004 112.021 -178.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.456 ' HB3' HD12 ' A' ' 50' ' ' LEU . 9.5 ptm180 -65.24 -32.39 74.03 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.995 0.426 . . . . 75.329999999999998 110.899 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.16 -43.8 50.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.42 0.629 . . . . 64.25 109.561 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.421 ' NE2' ' HE3' ' A' ' 43' ' ' LYS . 93.3 mt-30 -72.58 -30.13 64.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.09 -0.959 . . . . 72.219999999999999 111.831 -177.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.87 30.41 17.88 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.523 -1.031 . . . . 74.340000000000003 110.523 -171.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.886 ' HE2' ' HA ' ' A' ' 49' ' ' LYS . 10.2 mmpt? -102.35 -8.44 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 115.3 -0.45 . . . . 74.340000000000003 110.257 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 41' ' ' GLN . 2.9 mt -63.33 139.02 97.51 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.603 -0.726 . . . . 74.510000000000005 109.51 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.715 ' HD2' HD23 ' A' ' 50' ' ' LEU . 56.5 Cg_endo -75.71 145.19 28.82 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.105 1.87 . . . . 73.540000000000006 112.337 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.1 -30.4 70.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.347 -0.842 . . . . 52.539999999999999 110.264 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.694 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.7 m-20 -59.73 -51.01 71.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.914 -0.584 . . . . 71.040000000000006 110.828 176.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.469 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 2.3 tmt_? -57.31 -38.23 73.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.096 0.474 . . . . 64.310000000000002 110.018 -179.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttt180 -64.6 -49.58 70.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.797 -0.638 . . . . 71.439999999999998 110.475 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 tt -64.87 -40.02 94.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.352 -0.84 . . . . 74.409999999999997 110.13 -176.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.694 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.4 mt -55.12 -39.94 69.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 73.310000000000002 111.042 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 87.3 mt -61.85 -45.48 93.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.036 -0.529 . . . . 71.230000000000004 110.665 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -65.36 -33.42 75.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.972 0.415 . . . . 63.310000000000002 110.879 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.71 -36.14 75.65 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.929 -0.578 . . . . 74.340000000000003 111.16 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.696 HG21 ' HG2' ' A' ' 17' ' ' LYS . 19.5 pt -85.68 -26.57 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.594 -0.275 . . . . 62.439999999999998 111.524 176.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 109.97 33.85 2.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.548 -0.834 . . . . 60.5 112.797 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.607 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 77.8 t80 -72.31 135.21 45.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.877 0.37 . . . . 64.510000000000005 110.328 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 p -92.99 126.62 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-O 121.55 0.69 . . . . 71.120000000000005 110.554 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 76.3 m95 -92.18 32.02 1.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.583 -0.735 . . . . 73.349999999999994 109.967 -178.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 m 74.61 -47.42 0.63 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.516 -0.766 . . . . 74.129999999999995 110.665 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.499 HD23 ' H ' ' A' ' 67' ' ' LEU . 2.4 pt? -127.9 158.59 37.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.868 0.366 . . . . 75.239999999999995 110.112 175.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -107.45 -84.67 0.52 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.365 -0.606 . . . . 52.399999999999999 109.365 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -156.92 -171.79 3.79 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.417 -0.957 . . . . 64.239999999999995 108.417 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -98.35 58.97 1.31 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.72 -1.215 . . . . 71.129999999999995 107.72 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 -90.64 -57.75 2.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.769 -1.105 . . . . 62.43 111.589 -168.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.601 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 50.8 t-80 -133.4 72.34 1.48 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.853 -0.339 . . . . 62.43 111.677 -174.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.601 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 28.8 t60 168.79 -85.01 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.413 -0.812 . . . . 72.439999999999998 109.798 170.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.4 ' H ' ' HB3' ' A' ' 73' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.244 0.805 0 CA-C-O 118.881 -0.58 . . . . 75.25 109.484 -178.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.6 ttm . . . . . 0 N--CA 1.479 1.018 0 N-CA-C 110.278 -0.268 . . . . 70.219999999999999 110.278 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 68.2 -75.83 0.06 Allowed 'General case' 0 CA--C 1.532 0.257 0 O-C-N 123.801 0.688 . . . . 74.5 112.06 176.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.778 ' HG2' ' HG3' ' A' ' 11' ' ' LYS . 36.5 mt-30 57.41 36.77 27.48 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 122.733 0.413 . . . . 70.209999999999994 111.378 -176.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 40.6 t-20 -61.85 146.73 48.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.939 -0.393 . . . . 74.209999999999994 109.939 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.61 ' H ' HD12 ' A' ' 5' ' ' LEU . 5.8 mp -52.4 -41.01 62.79 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.334 0.588 . . . . 64.299999999999997 110.031 176.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -95.18 15.15 19.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.476 -0.784 . . . . 74.010000000000005 111.01 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -141.41 28.95 2.3 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.733 -0.746 . . . . 45.530000000000001 112.136 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -84.0 -14.67 50.14 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.95 -0.3 . . . . 73.120000000000005 110.466 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.474 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -58.27 -56.58 20.21 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.023 -0.732 . . . . 65.219999999999999 109.023 178.843 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 47.9 ttm -55.32 -33.81 63.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 52.420000000000002 110.871 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.778 ' HG3' ' HG2' ' A' ' 3' ' ' GLN . 0.4 OUTLIER -68.36 -53.98 20.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.56 -0.745 . . . . 72.109999999999999 110.471 -177.573 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -77.11 -20.06 56.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.75 0.309 . . . . 75.239999999999995 111.077 -176.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 17' ' ' LYS . 74.8 t80 -51.38 -43.78 61.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 74.219999999999999 110.137 173.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -62.91 -36.4 83.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.891 -0.595 . . . . 74.319999999999993 111.304 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.3 -44.1 92.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 73.030000000000001 111.237 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.442 HD23 ' O ' ' A' ' 16' ' ' LEU . 3.4 tt -79.14 -32.58 44.43 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.591 -0.892 . . . . 72.140000000000001 108.591 -176.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 13' ' ' TYR . 84.5 tttt -51.38 -51.91 50.49 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.729 -1.123 . . . . 73.299999999999997 110.511 174.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 25.6 t -76.58 -34.62 58.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.495 -0.775 . . . . 74.540000000000006 110.685 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.55 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 3.1 t80 -66.0 -45.35 81.89 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.869 0.366 . . . . 73.319999999999993 110.861 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.551 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 7.7 p -65.75 -34.4 70.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.373 -0.376 . . . . 73.329999999999998 111.588 -176.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.457 ' HD2' ' C ' ' A' ' 21' ' ' ARG . 5.6 ppt_? -79.43 -16.39 56.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.352 0.596 . . . . 73.120000000000005 110.325 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.8 tptm -89.31 -53.72 4.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.694 -0.685 . . . . 75.219999999999999 111.137 -174.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -115.57 -10.36 11.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.8 -0.182 . . . . 75.219999999999999 111.364 -178.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.551 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 64.16 93.45 0.06 Allowed 'General case' 0 CA--C 1.518 -0.286 0 O-C-N 123.667 0.604 . . . . 75.340000000000003 110.126 -170.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.665 ' HD3' ' O ' ' A' ' 64' ' ' VAL . 57.0 mtm180 65.92 -174.69 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 114.569 -1.196 . . . . 74.299999999999997 110.551 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.787 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 2.9 p90 -127.49 81.39 70.22 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.785 -0.643 . . . . 74.239999999999995 109.819 171.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -66.46 107.12 1.16 Allowed 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 123.099 2.533 . . . . 50.450000000000003 112.169 -176.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 59.99 25.53 14.74 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.877 -0.601 . . . . 72.439999999999998 111.17 177.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.787 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 45.2 m -88.9 133.73 34.2 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.814 -0.63 . . . . 73.129999999999995 109.422 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.437 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 9.2 p -72.26 -42.67 65.35 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.514 -0.312 . . . . 71.219999999999999 110.947 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' CD ' ' H ' ' A' ' 32' ' ' GLY . 1.7 tm-20 56.3 -158.38 0.24 Allowed 'General case' 0 CA--C 1.532 0.255 0 O-C-N 123.691 0.62 . . . . 72.099999999999994 110.003 177.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.44 ' H ' ' CD ' ' A' ' 31' ' ' GLU . . . -130.38 -87.49 0.46 Allowed Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 111.248 -0.741 . . . . 70.239999999999995 111.248 176.158 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 37' ' ' TRP . 6.9 p30 -70.21 -38.68 75.32 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.461 0.171 . . . . 61.310000000000002 111.461 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.43 -28.31 59.31 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.869 0.366 . . . . 53.32 110.807 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.437 ' HA3' ' O ' ' A' ' 30' ' ' THR . . . -61.16 -45.59 96.24 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.689 -0.767 . . . . 74.239999999999995 111.53 178.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.03 -29.31 59.03 Favored Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 111.143 -0.783 . . . . 65.310000000000002 111.143 176.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.466 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 2.7 t90 -58.16 -55.79 30.42 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.085 0.554 . . . . 73.219999999999999 110.508 178.053 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.32 -46.76 87.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 73.040000000000006 110.787 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.444 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.3 m80 -57.43 -46.21 83.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.122 -0.49 . . . . 75.5 112.013 -178.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.3 t -70.65 -35.08 72.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.018 0.437 . . . . 62.520000000000003 110.848 -175.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.598 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 3.0 mt-30 -86.42 -21.39 27.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.23 0.826 . . . . 70.219999999999999 113.23 -172.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -69.17 -22.75 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.095 -0.642 . . . . 75.120000000000005 109.494 174.991 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 2.8 tmmm? -73.45 -30.41 63.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.359 -0.837 . . . . 70.349999999999994 109.952 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.598 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 13.4 mmt -67.62 -33.83 75.77 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.744 0.307 . . . . 74.299999999999997 110.39 174.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.739 ' HB2' HD12 ' A' ' 50' ' ' LEU . 17.4 tpt180 -72.98 -39.06 66.41 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.519 -0.472 . . . . 75.099999999999994 110.389 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -56.93 -44.76 82.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.372 0.606 . . . . 72.209999999999994 109.602 173.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.496 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 58.9 mt-30 -64.83 -29.58 70.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.191 -0.913 . . . . 71.400000000000006 110.996 174.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.99 28.65 44.86 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.969 -0.634 . . . . 75.129999999999995 111.582 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.496 ' HG2' ' HB2' ' A' ' 47' ' ' GLN . 18.3 ptmt -113.16 0.42 14.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 73.239999999999995 111.025 -176.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.739 HD12 ' HB2' ' A' ' 45' ' ' ARG . 1.8 mt -58.81 139.94 86.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.81 -0.632 . . . . 75.409999999999997 110.207 179.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 4.3 Cg_exo -82.23 158.63 17.56 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 122.672 2.248 . . . . 73.530000000000001 111.486 173.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -71.08 -31.8 68.28 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.07 -0.968 . . . . 73.510000000000005 110.643 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.6 -51.24 50.32 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.917 -0.583 . . . . 74.140000000000001 112.231 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.582 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 47.5 ttt-85 -60.92 -50.52 73.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.047 0.451 . . . . 72.420000000000002 110.451 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.408 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -64.89 -26.83 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.764 -0.653 . . . . 61.420000000000002 110.964 -178.57 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -77.11 -51.73 10.52 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.212 -0.449 . . . . 74.530000000000001 110.726 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.2 mp -58.99 -43.23 91.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.447 -0.342 . . . . 53.350000000000001 111.043 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.631 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 71.2 mt -62.24 -40.77 97.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 75.340000000000003 110.31 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.408 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 15.6 t70 -57.68 -41.18 81.09 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.861 -0.609 . . . . 45.219999999999999 111.105 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.439 ' N ' ' HD2' ' A' ' 60' ' ' LYS . 1.6 mptp? -77.31 -28.93 53.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.756 -0.656 . . . . 74.319999999999993 112.589 -173.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 16.1 pt -82.85 -14.34 11.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.269 -0.572 . . . . 71.140000000000001 110.89 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 112.16 23.52 5.48 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.37 -0.919 . . . . 33.229999999999997 113.532 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.631 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 32.6 t80 -88.58 103.8 16.24 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.344 0.592 . . . . 53.509999999999998 109.794 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.665 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 14.4 p -99.02 129.17 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-N 115.205 -0.907 . . . . 72.030000000000001 110.775 -177.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -68.57 -29.42 67.96 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.332 -0.395 . . . . 72.120000000000005 111.236 -175.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 42.2 m 64.68 -177.71 0.17 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.78 -0.646 . . . . 71.420000000000002 111.865 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.548 HD23 ' H ' ' A' ' 67' ' ' LEU . 2.6 pt? -86.22 14.93 5.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.143 -0.481 . . . . 70.540000000000006 111.533 -176.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -80.16 2.6 23.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.193 0.521 . . . . 60.130000000000003 110.993 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -136.81 -51.16 0.67 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.375 -0.602 . . . . 63.130000000000003 109.375 173.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -95.86 105.64 17.67 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.11 -0.7 . . . . 73.420000000000002 109.11 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -81.91 169.13 17.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.929 -0.578 . . . . 75.219999999999999 110.693 -175.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -91.39 137.34 32.44 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.335 -0.617 . . . . 74.510000000000005 109.335 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.13 -35.6 71.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.894 0.378 . . . . 73.319999999999993 111.037 -176.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.16 -0.924 . . . . 73.430000000000007 109.469 173.45 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 120.751 0.31 . . . . 61.009999999999998 110.393 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -79.59 79.07 6.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.547 0.689 . . . . 71.129999999999995 111.381 -178.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -165.59 82.86 0.33 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.679 -1.146 . . . . 71.219999999999999 107.954 173.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -127.67 -1.97 6.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.43 -0.805 . . . . 74.129999999999995 111.671 -171.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.3 mt -75.28 -41.23 57.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.486 -0.325 . . . . 65.200000000000003 110.593 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 67.58 146.3 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.901 0.75 . . . . 62.039999999999999 112.26 -178.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 70.53 35.78 68.15 Favored Glycine 0 N--CA 1.444 -0.782 0 CA-C-N 115.511 -0.768 . . . . 74.109999999999999 113.029 174.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 8.4 tm-20 -63.59 -27.54 69.31 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 109.048 -0.723 . . . . 65.340000000000003 109.048 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.468 ' HZ2' HD13 ' A' ' 57' ' ' LEU . 6.2 t-105 -61.58 -48.63 80.1 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.908 0.385 . . . . 72.329999999999998 110.36 173.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 78.1 mmm -61.6 -29.88 70.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 74.049999999999997 110.42 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HB3' ' HE3' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -78.26 -49.6 13.41 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.522 -0.763 . . . . 71.030000000000001 109.788 176.587 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 8' ' ' GLU . 2.0 t-20 -52.74 -35.67 56.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.194 0.998 . . . . 74.200000000000003 111.164 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -52.87 -39.41 62.6 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.979 -1.009 . . . . 73.510000000000005 110.833 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -63.44 -43.24 97.97 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.139 0.274 . . . . 75.099999999999994 111.521 -177.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.406 ' HB3' HD11 ' A' ' 34' ' ' LEU . 3.3 mp0 -63.52 -40.45 97.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.002 0.43 . . . . 73.519999999999996 110.771 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.9 tp -78.65 -45.36 21.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.439 0.638 . . . . 74.400000000000006 109.321 -173.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -51.05 -51.02 57.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.442 -1.254 . . . . 63.520000000000003 111.353 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.0 m -70.41 -38.28 74.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.251 -0.886 . . . . 71.129999999999995 111.029 -176.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.413 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 17.2 t80 -76.36 -44.98 34.05 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.446 -0.502 . . . . 72.109999999999999 111.092 -173.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.682 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 54.5 t -61.4 -33.91 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.144 -0.48 . . . . 73.109999999999999 110.993 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.464 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -58.26 -29.26 65.65 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.112 0.482 . . . . 55.32 110.767 176.013 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -91.26 -61.58 1.63 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.225 -0.443 . . . . 62.43 111.703 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -101.59 -6.7 23.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.35 0.5 . . . . 64.230000000000004 112.35 -174.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.682 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 28.4 mmt180 68.43 -0.59 2.17 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.173 0.589 . . . . 71.109999999999999 111.684 -178.015 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 80.9 mtt180 -168.71 172.01 8.25 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.326 1.05 . . . . 72.040000000000006 108.722 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.589 ' HB2' ' O ' ' A' ' 29' ' ' SER . 10.2 p90 -126.93 86.07 59.63 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 121.345 0.593 . . . . 71.450000000000003 110.332 172.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.02 -49.5 0.38 Allowed 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.855 2.37 . . . . 73.310000000000002 112.341 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -102.95 -39.07 7.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.419 -0.355 . . . . 74.409999999999997 110.703 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.589 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 52.8 m -77.81 89.47 4.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.44 . . . . 74.340000000000003 111.452 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 34' ' ' LEU . 4.9 p -83.44 -55.24 4.42 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.973 -0.558 . . . . 65.019999999999996 111.177 179.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 66.01 159.99 0.13 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.038 -0.528 . . . . 74.040000000000006 110.291 -176.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.84 -51.16 57.74 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.443 -0.884 . . . . 31.23 112.519 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.442 ' HB3' HD21 ' A' ' 12' ' ' ASN . 15.0 m120 -66.1 -55.27 17.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.562 -0.319 . . . . 72.450000000000003 111.792 -176.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 30' ' ' THR . 83.0 mt -71.9 -38.76 69.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.415 -0.357 . . . . 74.230000000000004 111.756 -173.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.95 -43.74 96.6 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.923 -0.656 . . . . 43.0 111.889 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.19 -34.77 54.49 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.382 -0.687 . . . . 64.200000000000003 111.382 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.506 ' HH2' HD21 ' A' ' 58' ' ' LEU . 9.0 t90 -54.34 -52.22 62.26 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.31 0.576 . . . . 72.430000000000007 109.831 174.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.485 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.1 t -62.49 -46.33 88.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.937 -1.029 . . . . 55.530000000000001 111.131 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -56.77 -45.56 82.04 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.832 0.308 . . . . 73.230000000000004 111.832 -177.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.456 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 91.6 m -65.07 -48.17 74.73 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.314 -0.403 . . . . 64.010000000000005 111.691 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -84.7 -24.41 28.95 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.217 0.821 . . . . 71.439999999999998 113.217 -170.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' C ' ' HD2' ' A' ' 42' ' ' ARG . 1.4 tmm_? -62.88 -33.34 75.09 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.731 -0.84 . . . . 73.040000000000006 108.731 173.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 40' ' ' THR . 62.3 tttt -61.88 -50.52 71.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.248 -0.887 . . . . 74.530000000000001 110.575 175.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.664 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.6 mmt -61.39 -34.0 74.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 75.319999999999993 110.848 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.02 -48.11 81.75 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.458 -0.571 . . . . 61.310000000000002 109.458 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.9 tttp -66.65 -49.32 66.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.287 -0.869 . . . . 74.129999999999995 111.054 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -60.79 -32.08 71.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.943 -0.571 . . . . 73.349999999999994 111.757 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.32 41.01 5.91 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.581 -0.819 . . . . 60.350000000000001 111.95 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -133.31 11.47 4.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.014 0.435 . . . . 75.010000000000005 111.459 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.664 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 4.1 mt -64.79 141.24 98.28 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-N 115.88 -0.6 . . . . 63.43 109.808 175.379 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.69 134.84 31.42 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.72 2.28 . . . . 74.140000000000001 111.755 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -60.19 -39.48 86.7 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.378 -0.828 . . . . 72.319999999999993 109.942 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.637 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.8 m-20 -56.61 -43.72 80.45 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.729 -0.669 . . . . 65.430000000000007 110.44 176.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -62.5 -49.47 75.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.563 -0.744 . . . . 42.340000000000003 110.265 -178.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -51.73 -44.37 63.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.403 -0.817 . . . . 74.329999999999998 110.309 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.604 ' HA ' ' OD2' ' A' ' 59' ' ' ASP . 7.0 mp -64.7 -41.71 95.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 72.109999999999999 111.481 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.1 mt -53.19 -39.38 63.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.937 0.399 . . . . 65.540000000000006 110.648 178.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 4.3 mm? -68.48 -49.51 59.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.68 -0.691 . . . . 75.319999999999993 111.411 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.604 ' OD2' ' HA ' ' A' ' 56' ' ' LEU . 1.9 p30 -73.27 -20.56 60.8 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.154 -0.619 . . . . 73.109999999999999 111.03 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -65.86 -41.4 91.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.784 0.326 . . . . 74.450000000000003 111.407 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -84.61 -2.74 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 74.230000000000004 110.871 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.521 ' O ' ' HD2' ' A' ' 24' ' ' ARG . . . 97.23 22.89 15.79 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 120.76 -0.734 . . . . 34.210000000000001 113.609 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.593 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 72.1 t80 -75.05 133.31 41.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.473 0.654 . . . . 63.009999999999998 110.164 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.776 HG12 ' H ' ' A' ' 66' ' ' SER . 73.6 t -91.62 127.84 43.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.058 -0.974 . . . . 72.420000000000002 110.715 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.4 ' O ' ' HB2' ' A' ' 66' ' ' SER . 94.6 m95 -101.16 20.51 15.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.621 . . . . 73.230000000000004 109.842 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.776 ' H ' HG12 ' A' ' 64' ' ' VAL . 70.0 m 72.24 168.76 0.31 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.362 -0.836 . . . . 64.120000000000005 110.644 -173.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.441 ' H ' ' HG ' ' A' ' 67' ' ' LEU . 0.5 OUTLIER -78.24 58.68 2.12 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.456 0.646 . . . . 75.530000000000001 111.804 -177.183 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -76.18 87.2 3.03 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.645 -0.707 . . . . 74.239999999999995 110.882 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -135.6 136.92 41.44 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.072 -0.967 . . . . 72.340000000000003 108.883 175.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 29.5 m170 -74.75 126.22 30.42 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.201 0.524 . . . . 72.329999999999998 111.543 -175.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 9.9 p-80 -65.04 150.56 47.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.105 -0.952 . . . . 75.319999999999993 110.761 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -108.41 144.55 35.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.593 -0.521 . . . . 71.430000000000007 109.593 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -67.39 -53.09 32.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.989 -0.374 . . . . 65.319999999999993 109.989 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 52.5 t-80 . . . . . 0 C--O 1.251 1.174 0 CA-C-O 118.535 -0.745 . . . . 74.120000000000005 109.611 178.145 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.6 mtp . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.865 0.364 . . . . 74.519999999999996 110.634 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -130.09 -170.65 2.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.433 -0.349 . . . . 75.450000000000003 110.409 -178.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -80.81 84.28 6.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.996 0.903 . . . . 75.420000000000002 110.605 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 5' ' ' LEU . 26.3 p-10 -101.47 16.03 26.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.988 -1.006 . . . . 74.140000000000001 110.286 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 4' ' ' ASN . 94.3 mt 74.83 98.47 0.07 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.715 -1.13 . . . . 73.230000000000004 109.632 -175.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -104.01 170.21 8.05 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.392 -0.822 . . . . 75.319999999999993 110.174 -173.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.22 92.77 0.32 Allowed Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.189 -1.164 . . . . 54.299999999999997 110.189 169.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -60.08 -37.57 80.32 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.258 0.075 . . . . 71.349999999999994 111.188 -172.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.733 ' HH2' HH21 ' A' ' 54' ' ' ARG . 5.8 t-105 -59.33 -52.67 64.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.847 0.356 . . . . 72.329999999999998 110.429 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.503 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.1 tpt -56.88 -37.57 71.54 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.229 0.538 . . . . 61.32 110.29 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.444 ' C ' ' HD2' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.63 -46.91 51.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.64 -0.709 . . . . 72.519999999999996 110.594 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -56.82 -35.48 68.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.961 0.41 . . . . 65.239999999999995 110.767 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -59.94 -50.71 72.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.002 -0.544 . . . . 72.319999999999993 109.896 176.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 6.4 mm-40 -63.87 -39.04 93.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.083 -0.508 . . . . 73.329999999999998 110.717 176.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -61.82 -37.05 82.96 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.611 . . . . 74.140000000000001 110.282 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.764 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.0 tt -76.65 -43.21 39.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 65.349999999999994 111.016 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 58.2 mtpt -55.99 -57.02 13.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.329 0.585 . . . . 72.430000000000007 110.552 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.522 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 36.9 p -57.99 -30.2 65.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.853 -1.067 . . . . 74.25 111.322 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 34.8 t80 -70.62 -49.63 45.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.346 . . . . 72.510000000000005 110.305 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.2 t -59.63 -37.93 73.11 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 N-CA-C 111.777 0.288 . . . . 74.230000000000004 111.777 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.407 ' HG2' ' HA ' ' A' ' 18' ' ' SER . 19.7 ptt180 -74.71 -18.88 60.44 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.374 -0.53 . . . . 65.430000000000007 110.586 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 18' ' ' SER . 53.5 tttm -94.87 -46.38 6.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 64.25 111.335 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -118.31 -19.69 8.83 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.148 -0.221 . . . . 73.25 111.33 -176.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.626 HH12 ' HA3' ' A' ' 62' ' ' GLY . 11.3 mmm180 65.85 98.5 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 O-C-N 123.778 0.674 . . . . 73.040000000000006 111.563 -178.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.414 ' HG3' HG12 ' A' ' 64' ' ' VAL . 0.6 OUTLIER 71.29 163.4 0.26 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.936 -1.029 . . . . 75.25 110.962 179.074 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.572 ' HE2' ' HB3' ' A' ' 38' ' ' CYS . 8.4 p90 -140.79 83.37 14.5 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-O 121.518 0.675 . . . . 72.209999999999994 110.81 175.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -83.33 96.47 0.8 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.909 2.406 . . . . 73.109999999999999 111.22 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.538 ' HB2' ' NZ ' ' A' ' 28' ' ' LYS . 8.0 mtmp? 69.63 18.73 7.56 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.008 -0.542 . . . . 54.310000000000002 111.084 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.477 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 19.1 m -68.85 -40.31 79.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.553 -0.294 . . . . 61.140000000000001 111.044 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.511 ' HA ' ' HA2' ' A' ' 35' ' ' GLY . 0.2 OUTLIER 55.83 30.96 16.74 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.905 -0.589 . . . . 73.519999999999996 112.387 176.87 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -93.29 145.17 24.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.267 -0.424 . . . . 54.32 111.657 -178.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.21 -159.33 33.21 Favored Glycine 0 N--CA 1.451 -0.339 0 CA-C-N 115.659 -0.7 . . . . 24.239999999999998 112.321 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -70.74 -20.33 62.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.296 0.57 . . . . 72.230000000000004 109.717 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.764 HD11 ' HA ' ' A' ' 16' ' ' LEU . 57.2 mt -64.13 -33.68 76.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.213 -0.903 . . . . 72.430000000000007 111.155 -178.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.511 ' HA2' ' HA ' ' A' ' 30' ' ' THR . . . -51.65 -43.22 53.29 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.934 -0.651 . . . . 72.329999999999998 111.985 172.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.04 -31.45 34.94 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.849 -0.691 . . . . 75.319999999999993 111.697 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.411 ' HB2' ' HA ' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -56.87 -50.54 72.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.901 0.382 . . . . 64.150000000000006 110.719 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.572 ' HB3' ' HE2' ' A' ' 26' ' ' PHE . 30.0 p -65.05 -30.34 71.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 72.519999999999996 111.118 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -63.61 -47.25 82.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.788 0.328 . . . . 73.030000000000001 111.08 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.447 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 23.5 m -77.62 -20.86 53.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.205 0.526 . . . . 52.32 110.945 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.524 ' HG3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -77.64 -25.82 50.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.553 -0.294 . . . . 70.239999999999995 110.972 179.667 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 12.3 mmt180 -54.1 -47.1 72.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.226 0.536 . . . . 71.209999999999994 109.599 172.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 40' ' ' THR . 28.1 tttp -51.54 -62.56 1.55 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.624 -1.171 . . . . 63.310000000000002 111.181 175.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.431 ' HE2' HG22 ' A' ' 40' ' ' THR . 11.8 mmt -55.81 -46.22 78.11 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.058 -0.519 . . . . 73.209999999999994 112.229 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.612 ' NH2' ' HG3' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -65.13 -39.33 92.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.342 0.497 . . . . 74.120000000000005 112.342 -170.681 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.445 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 62.9 pttt -80.21 -19.19 47.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 75.310000000000002 110.4 -179.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -89.77 -14.86 33.64 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.445 -0.798 . . . . 75.329999999999998 110.876 178.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.92 27.49 68.71 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.833 -0.622 . . . . 42.009999999999998 112.297 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -100.53 -12.8 18.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.76 0.314 . . . . 73.409999999999997 110.748 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 1.021 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.5 OUTLIER -60.03 139.12 91.0 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.86 -0.609 . . . . 70.230000000000004 109.661 177.851 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 1.021 ' HD2' HD23 ' A' ' 50' ' ' LEU . 39.9 Cg_endo -73.28 127.92 12.39 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.303 2.002 . . . . 74.310000000000002 112.671 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.413 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 32.4 t-20 -59.39 -37.39 77.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.001 -0.999 . . . . 71.439999999999998 109.876 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -56.1 -48.58 75.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.569 -0.741 . . . . 50.420000000000002 111.306 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.733 HH21 ' HH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -71.14 -26.24 62.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.266 -0.424 . . . . 73.219999999999999 110.118 -175.187 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.413 ' HB3' ' O ' ' A' ' 52' ' ' ASN . 25.4 ttm-85 -61.84 -39.97 93.67 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.155 0.502 . . . . 73.420000000000002 109.792 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 mp -70.2 -32.14 69.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.595 -0.729 . . . . 63.030000000000001 110.76 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.72 -39.4 94.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.151 0.501 . . . . 75.439999999999998 109.8 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.745 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 82.3 mt -71.04 -33.43 70.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.842 -0.617 . . . . 44.530000000000001 110.17 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.49 -32.65 74.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 74.430000000000007 110.887 177.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -62.0 -40.44 95.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 54.130000000000003 111.608 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 11.2 pt -87.99 -12.38 10.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.855 0.359 . . . . 73.319999999999993 111.362 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.626 ' HA3' HH12 ' A' ' 24' ' ' ARG . . . 102.79 25.86 7.41 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.69 -0.767 . . . . 74.099999999999994 113.623 174.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.745 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 56.2 t80 -76.33 104.96 7.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.484 -0.561 . . . . 74.200000000000003 109.484 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.414 HG12 ' HG3' ' A' ' 25' ' ' ARG . 6.6 p -80.43 151.93 4.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 74.049999999999997 111.133 -175.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -116.24 28.72 8.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.492 -0.322 . . . . 73.430000000000007 111.622 -175.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.1 m -62.79 -21.01 65.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.211 0.449 . . . . 63.200000000000003 112.211 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 67' ' ' LEU . 5.5 mp -91.96 7.61 41.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.78 0.324 . . . . 64.319999999999993 111.26 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.612 ' HG3' ' NH2' ' A' ' 45' ' ' ARG . 21.2 tt0 -74.16 128.42 35.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.049 0.452 . . . . 64.230000000000004 111.246 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -72.11 143.56 48.97 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.336 -0.616 . . . . 62.329999999999998 109.336 177.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -67.4 -14.35 62.84 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.263 0.838 . . . . 73.430000000000007 113.263 -169.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 64.13 23.74 13.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.381 0.61 . . . . 74.239999999999995 110.897 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -104.76 160.37 15.04 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.202 -0.454 . . . . 70.140000000000001 110.308 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -89.49 124.72 34.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.345 -0.389 . . . . 64.310000000000002 110.739 -176.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 42.3 t-80 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.477 -0.773 . . . . 63.109999999999999 109.603 176.436 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 mpp? . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 120.501 0.191 . . . . 64.129999999999995 110.581 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -101.04 86.35 3.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.968 0.889 . . . . 74.209999999999994 109.107 171.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -94.57 -52.73 4.18 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.942 -1.027 . . . . 63.43 110.75 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -91.88 115.83 28.39 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.808 -0.633 . . . . 72.209999999999994 110.383 -178.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 82.5 mt -97.59 145.84 25.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.753 -0.658 . . . . 72.209999999999994 110.378 -178.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.438 ' OE1' ' HB2' ' A' ' 8' ' ' GLU . 12.3 tm0? -140.42 124.71 17.71 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.36 -0.607 . . . . 74.340000000000003 109.36 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.9 64.24 3.7 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.229 -0.51 . . . . 41.25 112.607 -174.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.438 ' HB2' ' OE1' ' A' ' 6' ' ' GLN . 20.9 tt0 -77.13 -26.31 53.04 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 110.17 -0.307 . . . . 63.420000000000002 110.17 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -45.55 84.92 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.823 -0.806 . . . . 73.420000000000002 108.823 175.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.5 ttm -58.09 -40.87 82.19 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.219 -0.446 . . . . 62.340000000000003 110.017 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -58.05 -55.84 29.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.391 -0.822 . . . . 61.130000000000003 110.098 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.99 -39.42 81.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.449 -0.796 . . . . 62.310000000000002 111.171 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -59.4 -47.96 83.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 75.310000000000002 110.824 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.31 -40.91 96.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.849 0.357 . . . . 61.219999999999999 111.119 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.691 ' HB3' HD21 ' A' ' 34' ' ' LEU . 16.5 mm-40 -62.67 -32.57 73.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.22 -0.446 . . . . 63.439999999999998 110.969 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.844 HD13 HD11 ' A' ' 58' ' ' LEU . 1.2 tt -84.79 -34.45 22.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.822 -0.807 . . . . 71.319999999999993 108.822 -178.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -55.38 -37.12 67.14 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.051 -0.977 . . . . 70.430000000000007 109.491 172.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -82.55 -27.65 31.49 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 73.129999999999995 110.951 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -75.27 -36.17 61.26 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.837 0.351 . . . . 75.5 110.843 -177.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.483 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 62.9 t -57.96 -38.02 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 73.209999999999994 110.276 173.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.532 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.5 tmt_? -76.03 -24.86 55.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.233 0.539 . . . . 74.209999999999994 109.944 176.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.436 ' HG3' ' CD2' ' A' ' 23' ' ' TYR . 24.5 tptm -71.66 -60.54 2.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.656 . . . . 75.5 111.482 -176.535 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.436 ' CD2' ' HG3' ' A' ' 22' ' ' LYS . 58.2 m-85 -126.15 3.96 7.15 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 63.219999999999999 112.196 -177.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.483 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 26.7 mmt-85 61.39 93.95 0.04 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.855 0.36 . . . . 74.209999999999994 110.802 -173.262 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.931 ' HG2' ' H ' ' A' ' 26' ' ' PHE . 40.2 ttt180 58.73 -169.57 0.13 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.618 -0.719 . . . . 74.349999999999994 109.927 -174.034 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.931 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 0.7 OUTLIER -141.25 140.02 20.15 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-O 120.746 0.307 . . . . 71.329999999999998 110.253 170.731 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.418 ' HD2' ' H ' ' A' ' 28' ' ' LYS . 4.8 Cg_endo -90.48 -26.47 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.246 2.631 . . . . 62.530000000000001 110.989 170.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.418 ' H ' ' HD2' ' A' ' 27' ' ' PRO . 85.2 tttt -175.07 81.26 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.799 -1.091 . . . . 65.349999999999994 108.41 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.5 p -78.2 142.77 37.7 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.85 -0.614 . . . . 41.210000000000001 111.591 -173.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.9 p -122.17 5.02 9.78 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.852 -0.613 . . . . 52.020000000000003 110.473 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -93.61 109.99 21.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.751 -0.659 . . . . 65.109999999999999 111.325 -172.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 54.49 -138.89 39.8 Favored Glycine 0 CA--C 1.517 0.198 0 CA-C-N 115.265 -0.88 . . . . 75.340000000000003 114.167 173.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -64.04 -35.35 80.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.438 -0.381 . . . . 74.140000000000001 111.233 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.691 HD21 ' HB3' ' A' ' 15' ' ' GLU . 2.7 mm? -64.25 -28.55 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 74.450000000000003 111.062 -176.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -55.87 -44.77 87.36 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 74.420000000000002 112.062 174.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -83.08 -28.0 38.76 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.682 -0.771 . . . . 65.5 112.177 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.438 ' CH2' ' HG2' ' A' ' 41' ' ' GLN . 16.5 t90 -57.87 -50.55 72.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.707 -0.246 . . . . 72.430000000000007 111.02 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 26.8 p -59.85 -40.97 90.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.228 -0.442 . . . . 61.409999999999997 110.756 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -59.02 -46.1 89.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 73.530000000000001 110.73 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -76.16 -40.17 53.23 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.771 -0.65 . . . . 73.209999999999994 111.259 -175.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.438 ' HG2' ' CH2' ' A' ' 37' ' ' TRP . 1.5 mp0 -78.7 -22.56 46.5 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.882 0.327 . . . . 53.240000000000002 111.882 -175.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.426 ' HD3' ' C ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -65.64 -33.22 75.39 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.702 -0.481 . . . . 73.0 109.702 176.379 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -58.42 -52.49 65.4 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.04 -0.527 . . . . 72.430000000000007 109.971 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.735 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 9.6 mmt -58.56 -33.35 69.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.335 -0.848 . . . . 74.040000000000006 110.657 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.95 -39.94 75.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.689 -0.687 . . . . 61.130000000000003 110.197 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -72.24 -48.5 42.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.876 -0.602 . . . . 55.119999999999997 110.698 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -63.56 -22.22 66.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.658 -0.701 . . . . 73.099999999999994 111.747 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 76.25 29.92 57.75 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.682 -0.771 . . . . 64.239999999999995 111.479 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -113.75 3.15 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.8 0.333 . . . . 63.32 110.45 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.735 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 2.6 mt -59.65 138.26 89.78 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.689 -0.687 . . . . 63.409999999999997 109.376 175.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.505 ' HG2' ' HB2' ' A' ' 54' ' ' ARG . 81.5 Cg_endo -84.62 149.45 11.35 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.218 1.945 . . . . 64.439999999999998 112.333 176.164 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -70.98 -27.44 63.71 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.15 -0.932 . . . . 75.430000000000007 109.976 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.55 -51.7 68.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 40.299999999999997 110.433 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.505 ' HB2' ' HG2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -63.87 -38.54 91.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 65.010000000000005 110.309 179.513 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -61.67 -45.94 91.87 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.038 -0.528 . . . . 61.100000000000001 110.563 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.3 tp -68.71 -42.27 77.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.387 -0.37 . . . . 65.439999999999998 111.55 -177.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.36 -39.46 79.61 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.737 0.303 . . . . 72.439999999999998 110.86 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.844 HD11 HD13 ' A' ' 16' ' ' LEU . 4.3 mm? -71.14 -43.31 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.24 0.543 . . . . 74.450000000000003 110.765 177.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.92 -28.55 69.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 64.340000000000003 110.231 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -74.61 -30.13 61.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 53.130000000000003 112.373 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.771 HD11 HD13 ' A' ' 58' ' ' LEU . 27.2 pt -87.72 1.47 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 120.519 -0.472 . . . . 61.210000000000001 111.101 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.88 16.31 31.19 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.449 -0.881 . . . . 73.319999999999993 113.021 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.55 105.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.062 0.458 . . . . 72.25 109.799 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.606 HG22 ' H ' ' A' ' 66' ' ' SER . 7.4 p -74.74 146.74 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 115.419 -0.81 . . . . 54.240000000000002 110.413 -177.359 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -107.8 14.33 25.57 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.624 0.249 . . . . 74.409999999999997 110.401 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.606 ' H ' HG22 ' A' ' 64' ' ' VAL . 68.5 m 59.82 -147.95 0.46 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.758 -0.655 . . . . 64.519999999999996 110.012 -175.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -87.29 -179.87 6.49 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.47 -0.567 . . . . 75.239999999999995 109.47 174.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 63.19 72.12 0.49 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.478 0.656 . . . . 64.400000000000006 111.688 -175.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 66.2 m-70 -93.44 14.13 19.55 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.311 -0.859 . . . . 75.409999999999997 108.996 173.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -73.52 154.68 39.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.02 -0.991 . . . . 75.340000000000003 110.11 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -61.31 112.05 2.0 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.958 0.409 . . . . 73.040000000000006 111.097 177.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.5 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 84.7 m-70 -131.34 126.39 35.15 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.14 -0.689 . . . . 72.430000000000007 109.14 174.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.5 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 14.3 m-70 77.78 6.2 2.82 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.802 0.689 . . . . 73.549999999999997 111.962 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.465 -0.779 . . . . 71.129999999999995 110.13 -179.342 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.1 tpt . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 120.708 0.29 . . . . 63.340000000000003 110.222 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -121.38 149.93 42.25 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.81 -0.441 . . . . 73.329999999999998 109.81 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -129.02 151.81 49.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.457 -0.338 . . . . 73.109999999999999 110.558 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 68.65 19.53 8.54 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.698 0.761 . . . . 72.140000000000001 110.67 172.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 47.5 tp -92.64 130.84 38.16 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.608 -1.178 . . . . 75.109999999999999 109.548 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -78.2 159.17 28.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.091 -0.504 . . . . 72.319999999999993 110.25 -178.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 72.69 36.68 58.13 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 110.778 -0.929 . . . . 74.25 110.778 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.601 ' HG3' ' HE2' ' A' ' 11' ' ' LYS . 17.5 tt0 -61.86 -29.74 70.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.541 0.21 . . . . 72.010000000000005 110.819 -177.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.431 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 19.1 t-105 -59.1 -49.33 78.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 74.409999999999997 109.88 173.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.4 ttm -61.6 -37.73 84.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.146 -0.479 . . . . 72.239999999999995 110.482 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.601 ' HE2' ' HG3' ' A' ' 8' ' ' GLU . 36.8 ttpt -56.93 -51.55 68.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.37 -0.832 . . . . 71.120000000000005 111.532 -178.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -78.18 -27.22 47.93 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.774 -0.37 . . . . 70.420000000000002 110.792 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -58.58 -46.05 87.78 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.492 -0.322 . . . . 74.329999999999998 111.351 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -65.16 -35.18 80.28 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 45.32 111.233 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.73 -33.66 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.278 0.561 . . . . 72.329999999999998 109.932 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 58' ' ' LEU . 47.0 tp -80.89 -39.93 25.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.347 -0.842 . . . . 72.400000000000006 109.537 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -55.6 -43.61 76.2 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.719 -1.128 . . . . 74.219999999999999 110.19 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.4 m -72.04 -34.93 69.17 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.492 -0.776 . . . . 72.040000000000006 110.425 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.658 ' HA ' ' HD2' ' A' ' 22' ' ' LYS . 32.0 t80 -71.82 -41.34 68.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 72.519999999999996 110.964 -175.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.68 -39.29 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.446 -0.343 . . . . 72.299999999999997 110.137 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -24.69 67.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.417 0.627 . . . . 73.400000000000006 109.847 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.658 ' HD2' ' HA ' ' A' ' 19' ' ' PHE . 42.0 mttm -77.53 -68.97 0.57 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.561 -0.745 . . . . 75.530000000000001 111.599 -178.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 45.8 m-85 -120.86 -15.24 8.37 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.027 -0.269 . . . . 75.530000000000001 111.518 -171.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 23' ' ' TYR . 1.1 mpp_? 70.72 111.53 0.06 Allowed 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 123.947 0.78 . . . . 73.430000000000007 110.789 -171.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.626 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 22.0 ttt180 71.55 -178.25 0.21 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.724 -1.126 . . . . 75.430000000000007 110.23 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.514 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 3.6 m-85 -105.53 86.55 1.79 Allowed Pre-proline 0 C--N 1.33 -0.24 0 N-CA-C 111.541 0.2 . . . . 64.109999999999999 111.541 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.626 ' HD3' ' O ' ' A' ' 25' ' ' ARG . 13.9 Cg_exo -70.01 -29.4 22.73 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 121.948 1.765 . . . . 72.0 110.658 173.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.644 ' HG3' ' H ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -89.56 -61.05 1.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.036 -0.983 . . . . 75.030000000000001 111.213 177.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.644 ' H ' ' HG3' ' A' ' 28' ' ' LYS . 47.6 m 69.31 175.86 0.28 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.211 0.604 . . . . 65.209999999999994 111.067 -174.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.72 39.74 20.61 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.619 0.6 . . . . 64.299999999999997 112.619 177.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -143.22 141.46 31.09 Favored 'General case' 0 C--N 1.333 -0.147 0 O-C-N 122.307 -0.245 . . . . 74.540000000000006 111.387 178.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 67.56 -162.27 47.78 Favored Glycine 0 C--N 1.333 0.374 0 CA-C-N 115.86 -0.609 . . . . 70.510000000000005 113.023 175.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -69.99 -23.77 63.21 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.904 -0.776 . . . . 65.340000000000003 108.904 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.548 HD21 ' HB2' ' A' ' 16' ' ' LEU . 88.9 mt -66.06 -30.23 70.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.952 -1.022 . . . . 64.0 111.248 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -53.73 -40.93 64.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.058 -0.591 . . . . 64.510000000000005 112.151 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.47 -32.33 31.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.778 -0.725 . . . . 61.439999999999998 111.626 176.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.667 ' CZ2' ' HD3' ' A' ' 54' ' ' ARG . 26.2 t90 -54.15 -55.27 29.36 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.178 0.591 . . . . 71.310000000000002 111.126 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 7.1 p -67.12 -30.79 70.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.788 -0.642 . . . . 55.149999999999999 111.624 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -67.35 -36.47 81.47 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.763 0.282 . . . . 64.519999999999996 111.763 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.0 m -72.08 -45.08 62.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.156 0.503 . . . . 52.439999999999998 110.885 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.46 ' HG2' HD21 ' A' ' 50' ' ' LEU . 19.3 mt-30 -80.68 -10.46 59.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.119 -0.491 . . . . 74.209999999999994 111.458 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 42' ' ' ARG . 4.8 tpt180 -56.27 -28.89 60.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.597 0.713 . . . . 55.219999999999999 109.429 171.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -88.08 -58.24 2.64 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.723 -1.126 . . . . 61.420000000000002 111.076 177.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.4 mmt -56.7 -33.02 66.04 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.747 -0.661 . . . . 75.329999999999998 112.105 -172.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.654 ' HA ' HD12 ' A' ' 50' ' ' LEU . 4.0 tmm_? -58.1 -50.53 73.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.324 -0.398 . . . . 75.109999999999999 111.115 -175.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -81.73 -16.59 50.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.011 0.434 . . . . 72.530000000000001 111.158 -174.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -99.65 3.64 45.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.141 -0.481 . . . . 74.230000000000004 111.483 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 64.0 27.17 70.94 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 120.779 -0.724 . . . . 75.349999999999994 112.315 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.747 ' HE2' ' HA ' ' A' ' 49' ' ' LYS . 10.3 mmpt? -99.34 -6.52 27.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.158 0.504 . . . . 73.200000000000003 109.85 -178.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.8 HD23 ' HD2' ' A' ' 51' ' ' PRO . 2.2 mt -62.32 141.02 96.4 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 115.161 -0.927 . . . . 72.510000000000005 110.258 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.8 ' HD2' HD23 ' A' ' 50' ' ' LEU . 64.5 Cg_endo -76.75 154.89 34.73 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.801 2.334 . . . . 62.119999999999997 112.997 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -71.76 -54.24 10.85 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.047 -0.979 . . . . 63.43 112.012 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.11 -34.88 64.06 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.023 0.44 . . . . 53.299999999999997 110.874 -175.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.667 ' HD3' ' CZ2' ' A' ' 37' ' ' TRP . 3.0 tmm_? -56.37 -42.85 78.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.403 -0.817 . . . . 73.510000000000005 110.134 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -67.0 -47.25 72.04 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 120.579 -0.448 . . . . 73.340000000000003 110.694 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.66 -39.82 91.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.931 -0.577 . . . . 53.149999999999999 110.993 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.429 HD22 ' HE1' ' A' ' 9' ' ' TRP . 9.1 mp -67.08 -37.05 83.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.109 -0.496 . . . . 72.319999999999993 110.958 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.869 HD11 HD21 ' A' ' 16' ' ' LEU . 3.8 mm? -67.78 -35.63 79.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.216 0.531 . . . . 65.510000000000005 110.411 176.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -64.51 -37.23 86.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.93 -0.577 . . . . 61.009999999999998 110.628 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -72.18 -31.88 66.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 74.209999999999994 112.19 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.8 HD11 HD13 ' A' ' 58' ' ' LEU . 25.1 pt -84.41 -12.92 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.598 -0.441 . . . . 62.409999999999997 110.751 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.28 34.85 4.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 72.530000000000001 113.534 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.427 ' CG ' HD12 ' A' ' 58' ' ' LEU . 81.0 t80 -74.49 126.51 30.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.893 0.378 . . . . 73.099999999999994 110.27 177.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.6 p -88.31 133.86 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-N 115.887 -0.597 . . . . 63.130000000000003 110.708 -178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 80.8 m95 -102.98 38.18 1.8 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.928 -0.578 . . . . 75.230000000000004 111.03 -176.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.1 p -86.73 110.3 19.81 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.097 -0.501 . . . . 54.409999999999997 111.031 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.7 mp -92.86 101.82 14.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.8 0.333 . . . . 72.140000000000001 110.525 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.41 -30.23 13.5 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.589 -0.523 . . . . 70.120000000000005 109.589 176.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -80.25 105.06 11.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.741 -0.663 . . . . 74.439999999999998 110.394 177.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -109.85 -168.09 1.28 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.94 -0.573 . . . . 73.409999999999997 109.555 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -132.02 116.31 16.92 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.941 0.4 . . . . 63.229999999999997 111.521 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 9.6 m80 -95.21 128.0 41.7 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.502 -0.925 . . . . 65.230000000000004 108.502 167.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 -69.09 124.25 23.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.812 0.339 . . . . 74.430000000000007 110.603 -173.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.3 m80 . . . . . 0 C--O 1.248 0.991 0 N-CA-C 109.182 -0.673 . . . . 74.099999999999994 109.182 174.857 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 109.229 -0.656 . . . . 74.25 109.229 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -80.44 -26.78 38.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.364 -0.38 . . . . 74.430000000000007 111.795 -174.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -93.34 144.46 25.3 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.945 0.403 . . . . 73.099999999999994 111.256 -174.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -93.47 152.28 19.18 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.738 -0.838 . . . . 73.109999999999999 108.738 172.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.7 tp -154.5 154.3 32.91 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.207 -0.294 . . . . 64.5 110.207 -175.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -61.66 115.8 4.25 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.455 -0.572 . . . . 75.120000000000005 109.455 172.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.49 45.0 0.75 Allowed Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 110.054 -1.218 . . . . 44.450000000000003 110.054 -172.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.602 ' HG3' ' HE2' ' A' ' 11' ' ' LYS . 28.5 tt0 -86.31 -12.5 49.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.079 -0.561 . . . . 75.219999999999999 110.786 -174.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 54' ' ' ARG . 22.7 t-105 -55.55 -49.61 72.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.352 -0.386 . . . . 71.439999999999998 110.182 175.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.462 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.5 tpt -55.73 -41.04 73.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.999 -0.546 . . . . 51.549999999999997 110.812 178.259 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.602 ' HE2' ' HG3' ' A' ' 8' ' ' GLU . 33.0 ttpt -67.33 -53.8 26.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 73.219999999999999 110.392 -178.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -61.25 -32.04 71.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 65.239999999999995 111.172 -179.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.434 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.8 t80 -63.43 -41.3 98.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 72.319999999999993 110.24 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.479 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 35.1 mm-40 -62.47 -42.19 99.3 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.476 -0.329 . . . . 72.5 110.508 178.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.528 ' HB3' HD11 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -60.96 -49.63 76.66 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.168 0.509 . . . . 53.439999999999998 110.37 174.052 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.428 HD21 ' CD1' ' A' ' 58' ' ' LEU . 27.0 tp -56.4 -51.63 67.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.205 -0.907 . . . . 73.299999999999997 111.611 -177.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.479 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 49.4 mtpt -50.92 -54.28 25.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.226 0.536 . . . . 63.229999999999997 110.705 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.647 ' O ' ' HD3' ' A' ' 22' ' ' LYS . 13.4 t -62.43 -46.88 86.52 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.116 -0.947 . . . . 62.43 111.146 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.644 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 10.5 t80 -70.26 -43.24 70.91 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.627 -0.26 . . . . 72.120000000000005 111.544 -172.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.606 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 91.7 t -67.58 -38.44 80.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.987 -0.285 . . . . 51.030000000000001 110.821 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.477 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -59.46 -28.86 67.37 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.074 0.464 . . . . 74.540000000000006 109.935 176.684 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.647 ' HD3' ' O ' ' A' ' 18' ' ' SER . 5.1 mptp? -79.71 -66.83 0.82 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.87 -0.605 . . . . 63.399999999999999 111.586 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.433 ' CD2' ' HB3' ' A' ' 22' ' ' LYS . 85.1 m-85 -113.59 0.86 14.77 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.926 0.713 . . . . 75.340000000000003 112.926 -169.001 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.606 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 15.1 mmt85 64.52 9.28 4.92 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.006 0.522 . . . . 75.040000000000006 112.18 177.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.7 ptt180 -178.06 178.19 0.96 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.585 -0.524 . . . . 74.109999999999999 109.585 -174.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.644 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 8.9 m-85 -105.99 86.8 2.09 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 109.411 -0.589 . . . . 72.120000000000005 109.411 173.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.23 -48.79 4.31 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.663 2.242 . . . . 75.329999999999998 112.96 -173.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -78.48 -33.94 47.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.163 -0.471 . . . . 64.310000000000002 110.746 -176.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t 65.12 -159.91 0.28 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.493 -0.776 . . . . 72.349999999999994 108.924 -172.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.9 p 59.93 5.16 0.69 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.125 0.97 . . . . 72.530000000000001 112.551 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.43 129.85 41.5 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.321 -0.992 . . . . 70.510000000000005 108.321 168.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -52.76 -73.7 0.37 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 121.231 -0.509 . . . . 74.019999999999996 113.731 -173.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.419 HD21 ' HG2' ' A' ' 15' ' ' GLU . 29.8 p-10 -70.24 -47.18 62.52 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.027 0.38 . . . . 73.030000000000001 112.027 -175.372 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.575 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 95.3 mt -75.71 -34.48 60.38 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 112.685 0.624 . . . . 72.109999999999999 112.685 -173.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.03 -40.36 98.39 Favored Glycine 0 N--CA 1.451 -0.321 0 N-CA-C 111.559 -0.616 . . . . 73.299999999999997 111.559 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.15 -28.77 43.7 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.396 -0.907 . . . . 42.219999999999999 111.381 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.618 ' HH2' HD21 ' A' ' 58' ' ' LEU . 20.0 t90 -56.75 -55.86 28.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 71.140000000000001 110.914 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.516 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 8.3 p -63.4 -42.29 98.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.465 . . . . 70.030000000000001 111.152 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -65.2 -28.78 69.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.026 -0.533 . . . . 61.219999999999999 111.72 -177.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.5 m -83.86 -39.2 20.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.926 0.393 . . . . 65.0 110.835 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.61 -30.83 70.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.310000000000002 111.954 -178.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -53.93 -38.86 65.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.1 0.476 . . . . 64.329999999999998 110.598 177.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.516 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 3.5 tmmm? -71.21 -37.06 72.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.579 -0.737 . . . . 70.150000000000006 111.035 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.5 mmt -62.5 -39.95 95.14 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.04 0.448 . . . . 73.340000000000003 110.655 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.49 ' N ' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -70.29 -48.36 57.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.615 -0.72 . . . . 74.140000000000001 110.55 -175.742 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 51.4 pttt -63.09 -24.95 68.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.123 0.487 . . . . 61.350000000000001 110.422 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -87.42 -1.33 57.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.863 -0.608 . . . . 74.150000000000006 111.169 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 58.74 30.92 66.57 Favored Glycine 0 N--CA 1.452 -0.269 0 CA-C-N 116.053 -0.521 . . . . 75.430000000000007 113.308 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.07 -0.8 11.03 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.607 -0.349 . . . . 73.510000000000005 111.501 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.758 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -61.33 140.23 94.61 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.096 -0.502 . . . . 74.450000000000003 109.711 172.307 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.758 ' HD2' HD23 ' A' ' 50' ' ' LEU . 55.3 Cg_endo -73.83 150.21 43.88 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.23 1.954 . . . . 72.349999999999994 112.231 178.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -69.61 -30.19 67.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.42 -0.809 . . . . 72.230000000000004 110.36 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.655 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 6.4 m-20 -69.69 -51.78 31.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.547 -0.751 . . . . 74.219999999999999 109.846 -175.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.638 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -56.54 -53.53 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.963 -1.017 . . . . 71.439999999999998 111.147 179.147 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -65.69 -24.74 67.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.414 -0.357 . . . . 72.209999999999994 111.055 -176.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.99 -38.58 64.1 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.72 -0.474 . . . . 64.030000000000001 109.72 176.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 82.7 mt -59.34 -44.18 92.67 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.801 -0.636 . . . . 74.209999999999994 110.01 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.618 HD21 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -62.02 -43.01 99.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.665 -0.698 . . . . 71.120000000000005 110.876 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.42 -33.78 74.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.517 -0.311 . . . . 72.109999999999999 110.86 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -64.14 -41.24 97.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 62.329999999999998 111.418 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.423 HG13 HG11 ' A' ' 20' ' ' VAL . 13.1 pt -83.12 -5.95 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.884 0.374 . . . . 71.549999999999997 110.893 177.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.442 ' HA3' ' NH1' ' A' ' 24' ' ' ARG . . . 85.96 41.32 7.19 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.027 -0.606 . . . . 65.310000000000002 113.24 173.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.456 ' CG ' HD12 ' A' ' 58' ' ' LEU . 78.6 t80 -81.19 135.54 35.77 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.128 0.49 . . . . 74.049999999999997 110.856 178.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.5 t -90.26 123.22 42.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.578 -0.737 . . . . 61.219999999999999 110.299 176.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -83.21 -26.47 30.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.165 -0.471 . . . . 64.530000000000001 110.229 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.8 m 65.33 120.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.6 0.714 . . . . 72.439999999999998 111.898 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 49.3 tp -99.8 130.88 46.04 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.944 -0.571 . . . . 52.32 109.801 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.87 133.67 43.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.085 -0.507 . . . . 65.329999999999998 110.691 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -80.97 -178.68 6.99 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.933 -0.576 . . . . 63.130000000000003 111.892 -175.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 -78.17 149.58 33.73 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.694 -0.685 . . . . 75.310000000000002 110.338 -177.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 45.7 m80 -93.27 152.61 19.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.52 -0.309 . . . . 54.100000000000001 110.265 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -85.56 71.58 10.73 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.241 0.46 . . . . 71.049999999999997 112.241 -170.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -175.73 150.04 1.01 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.715 -0.675 . . . . 52.450000000000003 109.534 173.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 58.9 m80 . . . . . 0 C--O 1.243 0.739 0 CA-C-O 118.271 -0.871 . . . . 65.25 109.785 175.63 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.44 -0.207 . . . . 75.040000000000006 110.44 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -142.63 148.58 37.66 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.847 -0.427 . . . . 72.209999999999994 109.847 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -98.99 50.72 0.96 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.732 -0.84 . . . . 70.129999999999995 108.732 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -75.75 -24.07 56.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.03 -0.986 . . . . 75.129999999999995 110.926 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.3 mt 63.4 -177.53 0.15 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.88 -0.6 . . . . 72.239999999999995 110.954 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 63.8 90.89 0.08 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.458 0.647 . . . . 71.049999999999997 110.864 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 141.08 54.91 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.448 -0.882 . . . . 71.340000000000003 112.665 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -85.41 -17.87 35.36 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.05 -0.352 . . . . 74.25 110.05 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.606 ' CZ2' ' HD3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -51.04 -56.37 12.88 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 108.913 -0.773 . . . . 71.239999999999995 108.913 174.134 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.456 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 18.4 mmt -57.73 -34.78 69.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.551 -0.75 . . . . 70.030000000000001 111.419 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.513 ' HE3' ' OE1' ' A' ' 15' ' ' GLU . 18.8 ttpt -66.85 -52.93 37.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.392 -0.367 . . . . 65.099999999999994 110.059 178.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.45 -34.9 77.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.839 -0.619 . . . . 51.539999999999999 110.862 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -59.04 -50.24 74.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 71.209999999999994 110.519 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -63.98 -35.93 82.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.386 -0.37 . . . . 70.420000000000002 111.422 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.513 ' OE1' ' HE3' ' A' ' 11' ' ' LYS . 32.8 mt-10 -73.21 -34.86 66.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.472 -0.331 . . . . 73.019999999999996 110.745 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.697 HD23 HD22 ' A' ' 58' ' ' LEU . 39.4 tp -73.08 -42.28 63.18 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.732 -0.84 . . . . 73.549999999999997 108.732 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -52.2 -49.3 64.17 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.054 -1.43 . . . . 75.319999999999993 110.965 174.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -62.74 -38.06 89.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 50.520000000000003 110.501 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.35 -39.91 62.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.669 0.271 . . . . 74.349999999999994 111.247 -175.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.27 -34.37 66.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.94 0.4 . . . . 73.099999999999994 110.291 174.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -71.15 -39.22 72.08 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.987 0.422 . . . . 74.219999999999999 110.08 175.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -65.06 -61.2 2.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.594 -0.73 . . . . 74.239999999999995 112.463 -177.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -122.54 -7.28 8.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.005 0.372 . . . . 73.129999999999995 112.005 -171.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 2.6 mmm180 64.55 99.79 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 O-C-N 123.527 0.517 . . . . 73.340000000000003 109.904 -173.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' HB3' ' O ' ' A' ' 24' ' ' ARG . 74.7 ttt180 67.28 172.16 0.26 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.781 -0.645 . . . . 75.010000000000005 109.634 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -72.15 151.71 92.48 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 110.35 -0.241 . . . . 62.109999999999999 110.35 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.38 91.97 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.323 2.015 . . . . 45.210000000000001 110.13 171.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.6 tmtp? 63.96 -74.26 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.44 -0.8 . . . . 64.109999999999999 109.578 -169.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 p -176.51 14.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.842 0.353 . . . . 45.229999999999997 111.12 178.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.9 p -92.81 54.9 2.3 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.283 0.475 . . . . 73.530000000000001 112.283 -172.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.481 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -100.01 153.97 18.77 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.534 -0.543 . . . . 64.109999999999999 109.534 178.003 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -87.57 -76.54 1.27 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.939 -0.648 . . . . 73.239999999999995 112.383 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -63.71 -55.03 26.42 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.18 0.514 . . . . 74.239999999999995 110.666 -177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.79 -24.75 59.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 71.340000000000003 110.335 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 31' ' ' GLU . . . -59.78 -37.79 92.97 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.3 -0.864 . . . . 51.229999999999997 111.668 175.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.35 -33.34 53.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.493 -0.861 . . . . 53.509999999999998 111.663 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -63.88 -47.23 81.47 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.088 0.47 . . . . 71.340000000000003 110.637 -179.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.0 p -71.61 -30.21 65.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.196 -0.457 . . . . 64.239999999999995 111.28 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -53.33 -38.89 63.63 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.096 0.474 . . . . 75.209999999999994 110.891 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.414 ' HA ' ' HD3' ' A' ' 43' ' ' LYS . 95.3 m -73.28 -39.87 65.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 65.439999999999998 111.257 178.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.436 ' OE1' ' HD2' ' A' ' 54' ' ' ARG . 31.8 mt-30 -85.41 -21.15 28.91 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.014 0.746 . . . . 75.439999999999998 113.014 -171.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.445 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -66.05 -27.91 68.45 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 43.520000000000003 109.497 175.012 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.445 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 16.4 mtpp -67.83 -50.45 56.62 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.233 -0.654 . . . . 74.519999999999996 109.233 172.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.698 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 18.1 mmt -55.39 -37.66 67.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.015 -0.993 . . . . 72.040000000000006 110.916 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.769 ' HB2' HD12 ' A' ' 50' ' ' LEU . 4.2 tmm_? -77.17 -41.24 42.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 61.219999999999999 110.749 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.47 -40.45 93.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.281 0.562 . . . . 74.349999999999994 109.633 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.473 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 4.3 tp-100 -70.52 -29.24 65.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.68 -0.691 . . . . 64.129999999999995 110.346 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.5 35.8 9.17 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.83 -0.7 . . . . 61.219999999999999 112.228 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.473 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 17.7 ptmt -124.24 3.51 8.52 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.57 0.211 . . . . 64.319999999999993 111.57 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.769 HD12 ' HB2' ' A' ' 45' ' ' ARG . 4.0 mt -62.38 140.29 96.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.026 -0.361 . . . . 72.150000000000006 110.026 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.719 ' HG2' ' HB3' ' A' ' 54' ' ' ARG . 66.5 Cg_endo -75.6 135.1 17.6 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.708 2.272 . . . . 55.539999999999999 111.862 175.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.544 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 27.8 p-10 -69.56 -24.74 63.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.826 -0.625 . . . . 72.420000000000002 111.414 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.613 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 29.1 m-20 -64.92 -51.77 60.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.758 0.313 . . . . 75.439999999999998 110.686 177.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.719 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -62.94 -42.1 99.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 74.430000000000007 110.37 175.48 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.544 ' HB3' ' HA ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -53.27 -40.8 64.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.593 -0.73 . . . . 71.109999999999999 111.017 172.847 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -69.13 -44.69 71.86 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.973 -0.38 . . . . 54.32 109.973 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 85.8 mt -55.22 -47.3 75.55 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.254 -0.43 . . . . 75.549999999999997 111.282 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.697 HD22 HD23 ' A' ' 16' ' ' LEU . 39.0 mt -71.52 -37.86 71.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.975 -0.557 . . . . 73.540000000000006 110.77 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.603 ' HB2' ' HE1' ' A' ' 65' ' ' TRP . 22.7 t70 -69.86 -24.53 63.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.208 -0.451 . . . . 72.109999999999999 110.908 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -42.81 70.74 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 116.062 -0.517 . . . . 73.430000000000007 110.446 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 15.4 pt -73.49 -33.86 40.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 120.914 0.388 . . . . 70.510000000000005 110.343 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 131.6 33.47 0.44 Allowed Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.454 -0.879 . . . . 72.430000000000007 113.368 173.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -87.17 102.45 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.29 0.566 . . . . 60.299999999999997 109.52 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.8 p -75.86 128.47 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-N 115.112 -0.949 . . . . 64.349999999999994 110.89 -175.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.603 ' HE1' ' HB2' ' A' ' 59' ' ' ASP . 74.8 m95 -88.64 -31.73 18.4 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.639 -0.71 . . . . 74.310000000000002 110.846 -177.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.9 m 59.44 29.01 18.53 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.889 -0.596 . . . . 75.209999999999994 111.198 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -78.67 86.23 4.65 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.385 -0.598 . . . . 62.509999999999998 109.385 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -98.27 82.21 2.88 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.587 -0.733 . . . . 72.310000000000002 110.544 -176.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -97.67 124.98 42.2 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.983 0.42 . . . . 75.340000000000003 110.469 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -78.74 139.38 38.45 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.834 -0.621 . . . . 55.240000000000002 110.316 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -76.46 157.0 32.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.858 0.361 . . . . 71.0 111.24 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -154.0 148.06 25.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.958 -0.565 . . . . 74.439999999999998 109.601 174.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 24.2 t-80 -115.26 -11.77 11.91 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.412 0.625 . . . . 70.329999999999998 109.34 176.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 . . . . . 0 C--O 1.249 1.052 0 CA-C-N 115.321 -0.854 . . . . 75.019999999999996 109.377 176.587 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.4 ttm . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.124 -0.324 . . . . 73.510000000000005 110.124 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -135.53 114.18 11.82 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.671 0.272 . . . . 65.420000000000002 110.737 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -92.22 5.13 51.59 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.341 0.591 . . . . 54.450000000000003 109.698 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -68.9 120.88 15.5 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.239 -0.891 . . . . 62.329999999999998 109.859 174.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.6 mp -72.28 100.69 2.67 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.391 0.615 . . . . 74.409999999999997 111.369 -178.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 23.8 tm0? -150.61 143.34 24.56 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.246 -1.391 . . . . 71.420000000000002 107.246 176.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -48.79 104.79 0.1 OUTLIER Glycine 0 C--N 1.331 0.264 0 O-C-N 123.878 0.736 . . . . 62.210000000000001 113.418 -174.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.86 -51.83 59.92 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 120.442 0.163 . . . . 72.0 110.853 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -59.18 -45.59 90.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.467 -0.333 . . . . 72.510000000000005 110.669 -178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.448 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 20.0 mmt -60.4 -39.96 89.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.065 0.46 . . . . 74.420000000000002 110.89 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 36.8 ttpt -69.5 -55.03 11.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 73.019999999999996 110.66 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -64.54 -33.35 75.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.706 -0.679 . . . . 73.400000000000006 111.933 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.434 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.7 t80 -59.08 -51.87 68.2 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 122.999 0.187 . . . . 74.420000000000002 110.503 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.814 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 73.6 mm-40 -59.6 -39.25 83.58 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.071 0.462 . . . . 73.109999999999999 111.016 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.525 ' CB ' HD21 ' A' ' 34' ' ' LEU . 52.8 mm-40 -66.15 -45.47 80.84 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 65.420000000000002 110.362 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.2 tp -62.98 -44.13 96.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.039 -0.528 . . . . 75.540000000000006 110.806 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.814 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.2 mtpt -50.99 -57.37 8.77 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.096 -0.502 . . . . 71.329999999999998 109.707 175.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -55.43 -42.76 74.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.049 -0.978 . . . . 61.119999999999997 111.951 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -62.67 -48.26 80.08 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.908 0.385 . . . . 65.239999999999995 111.353 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.715 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 32.9 t -72.3 -43.64 64.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.496 0.554 . . . . 75.519999999999996 112.496 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 17' ' ' LYS . 8.3 ppt_? -64.45 -15.76 61.26 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.954 -0.699 . . . . 75.319999999999993 110.848 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -87.25 -72.71 0.5 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.096 -0.502 . . . . 74.120000000000005 111.082 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -116.41 -6.87 11.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.32 0.489 . . . . 72.430000000000007 112.32 -170.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.715 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 12.1 mpt_? 66.05 13.71 9.23 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.851 0.46 . . . . 74.099999999999994 111.209 -176.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.631 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 12.7 ptt180 -161.94 175.61 11.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.586 0.231 . . . . 72.329999999999998 110.745 -175.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -104.45 87.83 1.88 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 73.099999999999994 110.744 175.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.631 ' HD3' ' O ' ' A' ' 25' ' ' ARG . 8.9 Cg_exo -70.91 -31.36 15.56 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.765 2.31 . . . . 73.420000000000002 111.739 -178.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -129.14 112.83 14.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.577 -0.738 . . . . 75.519999999999996 109.649 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.5 t -83.44 74.43 10.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.468 0.651 . . . . 73.219999999999999 110.586 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.2 p -109.81 4.78 22.06 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.754 0.788 . . . . 74.329999999999998 109.43 174.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.422 ' OE1' ' HB2' ' A' ' 33' ' ' ASN . 1.3 tm-20 -108.27 120.3 41.98 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.913 -1.04 . . . . 74.219999999999999 109.585 -177.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.63 -36.8 53.28 Favored Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 120.882 -0.675 . . . . 71.010000000000005 113.075 -175.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.422 ' HB2' ' OE1' ' A' ' 31' ' ' GLU . 90.1 m-20 -69.38 -54.62 13.54 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.598 -0.149 . . . . 71.409999999999997 110.598 -176.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.525 HD21 ' CB ' ' A' ' 15' ' ' GLU . 3.7 mm? -65.52 -32.01 73.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 74.450000000000003 110.642 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.19 -38.94 96.45 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.012 -0.614 . . . . 64.129999999999995 111.756 177.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.78 -31.53 35.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.33 -0.938 . . . . 74.219999999999999 111.561 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -58.79 -53.1 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.348 0.259 . . . . 75.420000000000002 111.063 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.7 p -62.25 -40.67 96.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.386 -0.37 . . . . 74.120000000000005 111.164 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -62.24 -45.58 92.67 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.871 0.367 . . . . 62.009999999999998 110.796 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.473 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 27.5 m -66.65 -38.38 86.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.894 -0.594 . . . . 72.230000000000004 110.856 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.595 ' HG3' HD21 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.93 -20.95 60.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.108 -0.497 . . . . 71.310000000000002 111.513 -177.169 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -59.78 -43.9 94.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.729 0.299 . . . . 70.140000000000001 110.473 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -64.78 -41.54 95.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.318 -0.401 . . . . 75.030000000000001 110.097 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.555 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 25.3 mmt -57.77 -41.55 82.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.905 -0.589 . . . . 74.430000000000007 110.414 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.548 ' C ' ' HD3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -69.84 -49.68 50.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.698 -0.683 . . . . 72.109999999999999 111.045 -178.604 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -75.88 -22.5 56.08 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.881 -0.328 . . . . 73.430000000000007 111.324 -173.212 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.54 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 17.7 tt0 -85.3 -8.72 58.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.041 0.448 . . . . 74.430000000000007 110.19 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.18 37.62 63.55 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.695 -0.684 . . . . 44.119999999999997 112.409 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 14.2 ptmt -131.95 12.45 4.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.058 0.392 . . . . 74.310000000000002 112.058 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -63.43 135.32 96.2 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 108.527 -0.916 . . . . 75.019999999999996 108.527 176.391 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.763 ' HG2' HH11 ' A' ' 54' ' ' ARG . 20.5 Cg_exo -69.12 138.79 40.75 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.835 2.356 . . . . 65.040000000000006 113.109 -177.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.477 ' HA ' ' HG2' ' A' ' 55' ' ' ARG . 89.1 m-20 -69.51 -31.07 69.09 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.842 -1.072 . . . . 74.010000000000005 110.136 176.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.62 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 13.1 t70 -71.26 -47.9 54.26 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.531 -0.759 . . . . 74.120000000000005 110.144 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.763 HH11 ' HG2' ' A' ' 51' ' ' PRO . 3.2 ttm105 -61.95 -42.73 99.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 64.030000000000001 111.12 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.477 ' HG2' ' HA ' ' A' ' 52' ' ' ASN . 18.4 ptp180 -66.44 -31.92 72.97 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 109.745 -0.465 . . . . 72.239999999999995 109.745 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.16 -37.97 75.33 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.255 -0.429 . . . . 44.509999999999998 110.216 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.5 mt -59.84 -38.83 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 72.430000000000007 110.391 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 54' ' ' ARG . 9.9 mp -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 75.420000000000002 110.655 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.33 -36.56 82.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.814 0.34 . . . . 63.43 110.793 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -67.59 -40.01 84.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 74.040000000000006 111.671 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.435 HG21 ' HG2' ' A' ' 17' ' ' LYS . 33.6 pt -76.31 -14.03 14.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 120.579 -0.448 . . . . 35.43 110.877 178.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 110.74 20.16 7.42 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.624 -0.798 . . . . 61.409999999999997 113.582 173.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -68.32 130.67 43.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.299 0.571 . . . . 71.5 110.603 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.646 HG22 ' H ' ' A' ' 66' ' ' SER . 11.3 p -94.2 139.93 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 CA-C-N 115.203 -0.908 . . . . 73.019999999999996 109.801 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -86.31 16.65 4.26 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.979 0.419 . . . . 74.400000000000006 110.652 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.646 ' H ' HG22 ' A' ' 64' ' ' VAL . 21.6 t 66.41 -176.41 0.19 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.333 -0.849 . . . . 72.319999999999993 111.002 176.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -85.52 137.43 32.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.208 -0.451 . . . . 70.0 109.808 178.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -126.63 154.18 44.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.346 -0.388 . . . . 72.239999999999995 110.111 179.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -91.89 92.92 8.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.501 0.667 . . . . 73.349999999999994 109.223 171.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -100.11 123.98 44.98 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.125 -0.943 . . . . 54.43 109.35 -174.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -66.8 120.37 13.42 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.098 0.475 . . . . 72.329999999999998 110.037 -178.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -64.38 132.1 49.12 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.266 -0.879 . . . . 71.129999999999995 111.509 -172.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -94.34 -13.18 26.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.638 -0.71 . . . . 72.099999999999994 109.159 174.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 . . . . . 0 C--O 1.253 1.265 0 CA-C-O 118.413 -0.803 . . . . 62.310000000000002 109.001 174.069 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.3 tpp . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 121.188 0.518 . . . . 74.450000000000003 110.489 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -93.57 166.57 12.18 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.945 -0.571 . . . . 65.319999999999993 110.706 -178.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -144.47 163.97 32.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.921 -0.581 . . . . 74.319999999999993 110.008 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -124.71 167.19 14.9 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.27 -0.423 . . . . 72.409999999999997 110.304 -178.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 mt -70.08 -45.78 66.29 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.778 -0.823 . . . . 64.400000000000006 108.778 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -167.32 158.44 11.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.397 -1.274 . . . . 60.530000000000001 108.622 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.3 9.12 48.63 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.252 -0.975 . . . . 64.450000000000003 111.596 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.37 -18.97 61.11 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.03 -0.73 . . . . 73.239999999999995 109.03 176.07 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.588 ' HZ2' ' HA ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -50.11 -51.89 39.29 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.384 -0.826 . . . . 64.319999999999993 109.897 176.701 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.429 ' SD ' ' N ' ' A' ' 10' ' ' MET . 1.5 mpt? -60.78 -38.15 84.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.992 -0.549 . . . . 75.439999999999998 110.762 -177.657 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.7 OUTLIER -69.95 -48.45 58.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.79 -0.641 . . . . 75.439999999999998 109.939 179.767 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -63.95 -35.83 81.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.996 -0.547 . . . . 64.340000000000003 110.673 178.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -61.62 -54.94 36.2 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 115.737 -0.665 . . . . 71.409999999999997 110.135 -177.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -62.57 -29.57 70.68 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.885 -0.326 . . . . 74.340000000000003 111.321 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 46.0 mt-10 -65.31 -39.46 92.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.054 0.454 . . . . 72.099999999999994 110.312 175.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -87.66 -35.14 18.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.765 -0.652 . . . . 74.430000000000007 109.734 -173.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -58.68 -47.73 83.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.527 -0.76 . . . . 64.530000000000001 110.568 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.3 t -69.97 -26.94 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.919 -0.582 . . . . 73.319999999999993 110.202 178.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.491 ' HE1' ' HA ' ' A' ' 26' ' ' PHE . 37.9 t80 -75.14 -52.26 11.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.175 -0.466 . . . . 73.109999999999999 110.547 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.623 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 8.2 p -62.85 -33.79 62.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 73.109999999999999 111.984 -176.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -76.17 -20.07 57.87 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.005 -0.434 . . . . 75.319999999999993 111.001 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.425 ' HD3' ' CE2' ' A' ' 23' ' ' TYR . 62.9 tttm -95.49 -55.32 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.647 0.261 . . . . 75.230000000000004 111.069 -179.125 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.425 ' CE2' ' HD3' ' A' ' 22' ' ' LYS . 84.6 m-85 -93.84 -18.9 21.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.715 0.265 . . . . 65.040000000000006 111.715 -173.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.623 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 30.3 mmm180 64.0 87.07 0.11 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.489 0.662 . . . . 72.299999999999997 110.618 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.439 ' H ' HG23 ' A' ' 20' ' ' VAL . 0.1 OUTLIER 68.89 176.19 0.27 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.417 -1.265 . . . . 72.409999999999997 111.208 -173.829 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.653 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 81.7 m-85 -74.85 143.54 78.31 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.529 -0.759 . . . . 73.439999999999998 110.455 175.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -72.82 -29.57 12.33 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.189 1.926 . . . . 65.530000000000001 110.563 171.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -174.98 -85.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.93 -1.032 . . . . 73.0 109.372 178.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.8 p 175.01 102.56 0.01 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.093 -0.958 . . . . 72.420000000000002 109.105 178.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.5 t -160.14 2.58 0.08 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.924 0.393 . . . . 75.530000000000001 111.276 -176.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.497 ' H ' ' CD ' ' A' ' 31' ' ' GLU . 1.3 pm0 -95.9 -166.7 1.47 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.292 -0.413 . . . . 62.399999999999999 110.45 -178.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -75.61 -118.19 0.12 Allowed Glycine 0 CA--C 1.52 0.403 0 C-N-CA 120.977 -0.63 . . . . 71.340000000000003 113.661 -173.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -59.84 -34.57 73.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.677 0.275 . . . . 50.439999999999998 111.654 -175.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.653 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 87.3 mt -60.81 -37.74 82.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.342 -0.39 . . . . 75.310000000000002 111.655 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.74 92.17 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.983 -0.627 . . . . 74.319999999999993 112.014 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.68 -38.96 12.73 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.719 -0.753 . . . . 72.299999999999997 111.68 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -55.17 -42.34 73.05 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 122.779 0.431 . . . . 71.430000000000007 111.097 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.1 t -65.98 -39.41 90.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.034 -0.53 . . . . 62.409999999999997 110.553 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -70.31 -37.26 74.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 71.329999999999998 111.727 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.6 m -68.93 -45.31 71.15 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.134 0.492 . . . . 72.319999999999993 110.838 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.73 ' HG3' HD21 ' A' ' 50' ' ' LEU . 2.8 mp0 -75.89 -17.24 59.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.085 -0.507 . . . . 63.439999999999998 111.588 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.5 tpt85 -59.87 -34.98 73.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.385 0.612 . . . . 72.010000000000005 109.863 173.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -74.14 -48.25 30.65 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.134 -0.939 . . . . 74.209999999999994 111.086 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.721 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.3 mmt -63.25 -29.57 70.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.885 -0.598 . . . . 72.439999999999998 110.987 -177.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -61.32 -50.39 73.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.836 -0.62 . . . . 74.400000000000006 111.172 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.418 ' HB2' ' HE3' ' A' ' 46' ' ' LYS . 20.4 ptmt -77.2 -18.47 57.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.047 0.451 . . . . 64.230000000000004 111.038 -175.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -84.75 -13.77 50.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.099 -0.5 . . . . 52.420000000000002 110.492 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.99 25.49 75.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.926 -0.654 . . . . 42.310000000000002 112.176 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.459 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.0 ptmt -109.99 -0.95 17.91 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.104 0.478 . . . . 73.420000000000002 110.303 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.73 HD21 ' HG3' ' A' ' 41' ' ' GLN . 4.7 mt -62.2 140.79 96.17 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.59 -0.732 . . . . 72.150000000000006 109.917 175.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.487 ' HB2' ' HB3' ' A' ' 54' ' ' ARG . 23.9 Cg_exo -65.83 127.27 17.49 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.303 2.002 . . . . 75.120000000000005 110.747 172.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -59.04 -33.7 71.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.828 -0.623 . . . . 64.129999999999995 110.63 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.668 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 30.8 m-20 -65.5 -46.71 78.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.199 -0.455 . . . . 73.219999999999999 110.023 175.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.588 ' HA ' ' HZ2' ' A' ' 9' ' ' TRP . 31.8 tpt85 -56.42 -33.48 65.87 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.082 0.467 . . . . 74.239999999999995 110.869 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.48 ' HA ' ' CZ2' ' A' ' 65' ' ' TRP . 0.2 OUTLIER -73.15 -38.93 66.06 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.337 -0.392 . . . . 73.409999999999997 110.843 176.74 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.7 tp -76.34 -40.15 52.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.581 -0.281 . . . . 54.340000000000003 111.194 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 63.3 mt -59.31 -33.72 71.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.93 0.395 . . . . 74.540000000000006 111.042 -178.3 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.525 ' HG ' ' NH1' ' A' ' 54' ' ' ARG . 3.2 mm? -71.97 -43.86 64.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 71.340000000000003 110.446 176.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.039 -0.528 . . . . 64.329999999999998 110.26 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 59.7 mmtt -53.04 -46.94 68.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.467 -0.788 . . . . 70.230000000000004 110.991 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 7.4 pt -89.87 1.83 7.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.701 -0.681 . . . . 72.319999999999993 111.887 -174.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.21 24.44 8.95 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.323 -0.941 . . . . 51.43 113.666 174.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.45 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 34.9 t80 -89.41 101.45 14.13 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.535 -0.913 . . . . 74.140000000000001 108.535 173.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.405 HG22 ' H ' ' A' ' 66' ' ' SER . 13.2 p -81.53 128.42 38.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.281 -0.872 . . . . 62.039999999999999 111.916 -171.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.487 ' HB2' HD11 ' A' ' 67' ' ' LEU . 58.9 m95 -90.84 -17.54 26.36 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.68 -0.691 . . . . 72.239999999999995 109.624 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.405 ' H ' HG22 ' A' ' 64' ' ' VAL . 49.2 m 71.63 -77.08 0.06 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.068 -0.969 . . . . 61.039999999999999 111.371 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.487 HD11 ' HB2' ' A' ' 65' ' ' TRP . 4.0 mp 58.78 179.73 0.07 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.657 0.742 . . . . 63.219999999999999 111.667 -176.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -85.67 130.11 34.65 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.29 -1.004 . . . . 73.310000000000002 108.29 166.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -60.88 95.26 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.248 0.547 . . . . 64.420000000000002 112.299 -174.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -144.69 152.14 39.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.304 -0.862 . . . . 72.540000000000006 108.769 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -102.3 109.96 21.78 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.612 -0.514 . . . . 70.150000000000006 109.612 175.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -61.94 105.72 0.61 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.343 0.592 . . . . 75.310000000000002 110.292 -177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -131.1 138.69 49.64 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.476 -0.784 . . . . 70.439999999999998 109.997 -176.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.216 -0.897 . . . . 63.5 109.651 175.944 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.4 mtm . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 121.246 0.546 . . . . 75.109999999999999 110.531 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.1 m-20 -117.82 38.16 3.73 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.689 -0.687 . . . . 71.099999999999994 110.447 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -71.79 171.92 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.773 -0.649 . . . . 70.439999999999998 111.342 -178.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -85.3 155.03 21.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.12 -0.491 . . . . 74.310000000000002 111.026 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 6' ' ' GLN . 88.4 mt 69.88 -69.34 0.17 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.656 0.783 . . . . 73.219999999999999 113.035 173.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 5' ' ' LEU . 54.6 mt-30 71.87 149.19 0.09 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.742 0.817 . . . . 73.019999999999996 111.026 -172.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.76 66.17 3.64 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 121.014 -0.612 . . . . 51.32 111.811 -177.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -75.52 -17.03 60.21 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.214 -0.194 . . . . 70.340000000000003 110.9 -176.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -63.42 -49.91 71.88 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.14 -0.318 . . . . 72.120000000000005 110.14 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.457 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.5 tpt -63.54 -34.92 78.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.101 0.477 . . . . 73.530000000000001 110.182 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.417 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.86 -48.21 39.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 73.400000000000006 110.556 -178.111 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -67.55 -39.47 84.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 64.349999999999994 111.465 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -62.83 -42.78 99.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.117 -0.233 . . . . 74.329999999999998 110.834 -176.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.99 -42.75 97.1 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.084 0.469 . . . . 64.040000000000006 110.869 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.99 -36.61 82.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.688 -0.687 . . . . 71.120000000000005 110.57 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 tp -81.96 -33.84 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 72.340000000000003 109.903 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -57.11 -52.05 66.85 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.699 -0.682 . . . . 70.319999999999993 109.999 175.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 m -68.51 -31.08 70.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.328 -0.851 . . . . 74.510000000000005 110.84 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -70.44 -50.63 36.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.428 -0.351 . . . . 64.209999999999994 110.316 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.638 ' HA ' ' H ' ' A' ' 25' ' ' ARG . 71.8 t -68.74 -36.88 76.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 CA-C-N 116.634 -0.257 . . . . 63.030000000000001 111.078 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -31.61 72.91 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.676 -0.41 . . . . 75.299999999999997 110.89 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -94.41 -54.32 3.58 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.934 0.346 . . . . 74.299999999999997 111.934 -175.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -97.57 -9.38 27.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.605 0.24 . . . . 72.420000000000002 111.417 -175.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.595 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 25.5 mmt180 55.78 79.97 0.15 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.84 -0.618 . . . . 72.510000000000005 111.558 -174.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.751 ' HD3' HG12 ' A' ' 64' ' ' VAL . 22.6 mtt180 70.25 171.74 0.31 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.13 -0.941 . . . . 65.310000000000002 111.017 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.525 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.3 p90 -115.78 85.63 14.65 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 121.235 0.54 . . . . 70.530000000000001 110.474 172.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.19 100.72 1.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.645 2.23 . . . . 74.409999999999997 112.108 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.0 mttt 57.95 39.64 26.4 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.757 -0.656 . . . . 64.540000000000006 110.533 177.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.525 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 37.0 m -93.35 173.75 7.55 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.649 -0.705 . . . . 51.450000000000003 111.391 -176.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p -120.45 71.16 0.91 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.606 0.717 . . . . 52.119999999999997 109.788 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.629 ' H ' ' CD ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -94.61 177.41 5.93 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.023 -0.99 . . . . 72.329999999999998 111.106 -175.127 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -90.37 -114.04 1.63 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.109 -0.567 . . . . 44.350000000000001 113.566 -174.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -55.33 -41.32 72.3 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.848 0.356 . . . . 74.450000000000003 111.406 -175.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.28 -33.47 73.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.533 . . . . 75.239999999999995 111.217 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.455 ' N ' ' HG2' ' A' ' 31' ' ' GLU . . . -61.29 -49.79 73.92 Favored Glycine 0 CA--C 1.5 -0.869 0 C-N-CA 120.745 -0.74 . . . . 64.549999999999997 111.324 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.18 -31.24 71.81 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.561 -0.828 . . . . 43.049999999999997 111.139 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.648 ' HH2' HD21 ' A' ' 58' ' ' LEU . 7.7 t90 -56.17 -56.13 24.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.25 0.547 . . . . 64.409999999999997 109.954 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.3 t -71.19 -44.98 64.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.511 -0.768 . . . . 64.219999999999999 111.477 -177.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -57.68 -28.63 63.96 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.812 0.339 . . . . 65.150000000000006 111.635 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.1 m -84.38 -51.15 7.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.17 0.509 . . . . 71.019999999999996 111.162 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.522 ' HB3' HD11 ' A' ' 50' ' ' LEU . 61.1 mt-30 -76.6 -24.22 53.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.946 0.721 . . . . 74.349999999999994 112.946 -170.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.565 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 13.2 ttt180 -55.83 -42.53 75.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.474 0.654 . . . . 70.239999999999995 109.404 173.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -76.11 -32.13 59.03 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.577 -0.738 . . . . 61.119999999999997 110.075 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 14.8 mmt -60.53 -45.76 92.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.398 -0.364 . . . . 65.400000000000006 111.521 176.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.605 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -65.58 -33.15 75.23 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.824 -0.35 . . . . 73.319999999999993 110.766 -177.974 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.469 ' HB2' HH11 ' A' ' 45' ' ' ARG . 5.2 tmmm? -73.87 -36.66 64.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.471 0.653 . . . . 71.230000000000004 109.53 176.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -73.56 -14.98 61.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.338 -0.846 . . . . 74.049999999999997 110.653 -178.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.624 ' C ' ' HE3' ' A' ' 49' ' ' LYS . . . 82.26 21.75 60.1 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.071 -0.585 . . . . 71.439999999999998 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.624 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 0.1 OUTLIER -95.09 -14.23 24.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.621 . . . . 32.32 110.535 -177.38 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.73 HD23 ' HD2' ' A' ' 51' ' ' PRO . 3.5 mt -93.6 141.74 24.25 Favored Pre-proline 0 C--N 1.315 -0.902 0 CA-C-N 115.315 -0.857 . . . . 64.409999999999997 110.248 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.73 ' HD2' HD23 ' A' ' 50' ' ' LEU . 83.7 Cg_endo -85.16 161.01 11.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.634 2.223 . . . . 65.439999999999998 111.736 170.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -71.35 -24.15 62.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.894 -0.594 . . . . 74.040000000000006 110.064 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.12 -51.75 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.734 -0.666 . . . . 74.239999999999995 111.192 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.4 ttm180 -67.87 -49.19 63.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.085 0.469 . . . . 74.209999999999994 110.376 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.52 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -50.41 -36.59 33.67 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.388 -0.824 . . . . 73.129999999999995 111.324 177.532 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.3 tp -68.35 -42.96 78.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 75.299999999999997 111.096 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.0 mp -62.35 -34.32 76.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.806 0.336 . . . . 64.209999999999994 110.869 178.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.648 HD21 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -65.65 -38.95 90.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.372 0.606 . . . . 54.350000000000001 110.473 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.52 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 12.4 t70 -64.94 -38.1 89.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.89 -0.595 . . . . 62.240000000000002 110.332 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -63.51 -41.7 98.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.775 -0.648 . . . . 74.319999999999993 111.969 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.453 HD11 HD13 ' A' ' 58' ' ' LEU . 35.3 pt -76.27 -16.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.563 -0.455 . . . . 63.009999999999998 110.906 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.67 33.6 3.28 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.731 -0.747 . . . . 45.539999999999999 112.984 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.429 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 48.0 t80 -93.79 133.78 36.81 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.072 0.463 . . . . 64.040000000000006 110.51 178.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.751 HG12 ' HD3' ' A' ' 25' ' ' ARG . 14.3 p -105.09 140.06 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-N 115.782 -0.644 . . . . 61.539999999999999 109.87 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -100.29 1.54 41.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.713 -0.222 . . . . 74.319999999999993 111.075 -177.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.721 ' H ' HG22 ' A' ' 64' ' ' VAL . 33.4 t 72.25 154.15 0.14 Allowed 'General case' 0 N--CA 1.465 0.321 0 O-C-N 124.022 0.827 . . . . 71.109999999999999 111.614 177.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.543 HD12 ' HB3' ' A' ' 70' ' ' HIS . 0.2 OUTLIER -80.3 -25.97 39.09 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.817 -0.809 . . . . 75.120000000000005 108.817 175.836 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 69.83 -71.25 0.13 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 114.778 -1.101 . . . . 74.109999999999999 112.85 174.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.443 ' O ' ' HB2' ' A' ' 70' ' ' HIS . 41.1 m80 -123.34 80.94 1.83 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.884 0.373 . . . . 75.120000000000005 111.731 -170.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.543 ' HB3' HD12 ' A' ' 67' ' ' LEU . 3.6 t-160 175.35 89.03 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.098 -0.955 . . . . 75.400000000000006 108.914 175.118 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -59.23 123.22 15.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.392 0.615 . . . . 75.329999999999998 111.142 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 62.4 m80 -80.72 142.64 33.65 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.477 -0.783 . . . . 65.099999999999994 109.307 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -120.4 149.17 42.78 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.833 -0.347 . . . . 73.340000000000003 110.858 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 60.2 m80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.351 -0.833 . . . . 75.120000000000005 109.703 179.439 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.6 mtt . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 120.683 0.278 . . . . 73.409999999999997 111.092 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -90.47 -24.86 20.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.629 0.252 . . . . 74.239999999999995 111.521 -177.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -103.09 108.57 19.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.031 0.443 . . . . 75.200000000000003 111.037 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -120.38 -53.82 2.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.595 -0.729 . . . . 72.329999999999998 109.534 175.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 85.7 mt 62.97 23.64 14.12 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.085 -0.961 . . . . 70.340000000000003 111.101 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -104.7 160.56 14.87 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.86 -0.609 . . . . 74.239999999999995 110.375 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.74 54.58 4.13 Favored Glycine 0 CA--C 1.517 0.192 0 C-N-CA 121.126 -0.559 . . . . 43.32 112.812 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -94.75 -33.29 12.95 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.061 -0.348 . . . . 71.150000000000006 110.061 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.499 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 23.8 t-105 -61.88 -44.72 96.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.042 -0.526 . . . . 70.120000000000005 111.866 -174.076 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.513 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 12.0 mmt -54.35 -37.82 65.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.088 0.47 . . . . 53.409999999999997 111.131 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -79.36 -49.09 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.965 -0.561 . . . . 71.099999999999994 110.243 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -52.71 -47.25 67.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.924 -1.035 . . . . 63.329999999999998 111.464 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -54.72 -51.94 64.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.861 -0.608 . . . . 70.140000000000001 110.934 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -66.72 -36.5 82.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 72.310000000000002 111.687 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.99 -36.53 69.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.178 -0.464 . . . . 74.409999999999997 110.631 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.455 HD23 ' O ' ' A' ' 16' ' ' LEU . 4.2 tt -77.36 -35.69 54.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.188 -1.041 . . . . 75.439999999999998 108.188 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.65 -42.09 74.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.785 -1.098 . . . . 63.039999999999999 110.395 174.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -74.85 -29.95 61.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.631 -0.713 . . . . 72.349999999999994 110.925 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -75.4 -46.18 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 73.349999999999994 111.435 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.567 HG11 ' HB ' ' A' ' 61' ' ' ILE . 8.1 p -65.25 -34.15 68.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.573 -0.285 . . . . 72.049999999999997 111.205 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -78.86 -16.42 57.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.137 0.494 . . . . 73.450000000000003 110.147 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -77.8 -67.43 0.73 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.805 -0.634 . . . . 74.150000000000006 110.986 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -116.86 12.98 14.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.621 0.23 . . . . 73.450000000000003 111.621 -176.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 16.1 mmt180 62.31 88.26 0.09 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.722 0.639 . . . . 72.409999999999997 110.733 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.475 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 tmt_? 70.57 166.0 0.29 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.581 -0.736 . . . . 55.149999999999999 109.317 -177.275 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.491 ' HB2' ' O ' ' A' ' 29' ' ' SER . 8.8 p90 -113.52 86.83 10.74 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 121.151 0.501 . . . . 74.329999999999998 111.3 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -89.79 -4.62 5.4 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 123.117 2.545 . . . . 65.230000000000004 112.603 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -137.3 -45.96 0.56 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.044 -0.525 . . . . 70.310000000000002 109.811 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.491 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 5.3 m -69.67 141.32 53.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.42 -0.809 . . . . 72.319999999999993 109.844 175.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.3 p -122.29 -37.9 2.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.66 0.267 . . . . 70.150000000000006 111.17 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 67.75 1.36 2.61 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 122.068 0.937 . . . . 63.409999999999997 110.977 176.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.84 -70.5 2.72 Favored Glycine 0 C--N 1.307 -1.073 0 CA-C-N 115.187 -0.915 . . . . 33.210000000000001 112.273 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.02 -48.81 56.53 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.525 0.195 . . . . 72.340000000000003 111.525 -176.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.1 mt -58.63 -42.56 88.54 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.738 0.304 . . . . 74.129999999999995 111.066 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -57.81 -42.99 94.84 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.078 -0.582 . . . . 74.340000000000003 111.956 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.79 -39.8 76.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.848 -0.691 . . . . 65.129999999999995 111.528 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -54.64 -48.97 71.63 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.483 -0.562 . . . . 73.430000000000007 109.483 176.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -64.07 -51.42 64.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.134 -0.939 . . . . 74.439999999999998 110.877 178.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -52.72 -44.71 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.363 0.505 . . . . 52.329999999999998 112.363 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 46.0 m -70.9 -45.23 64.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.158 0.504 . . . . 73.140000000000001 111.264 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.45 ' HG2' HD21 ' A' ' 50' ' ' LEU . 33.9 mt-30 -86.44 -12.58 48.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.764 1.024 . . . . 72.439999999999998 113.764 -171.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -73.74 -4.73 36.37 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.297 0.57 . . . . 72.040000000000006 109.952 174.026 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.743 ' HD3' ' HG3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -92.67 -47.78 6.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.504 -0.771 . . . . 63.310000000000002 108.982 172.299 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.754 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 12.5 mmt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.573 -0.739 . . . . 75.209999999999994 111.231 -175.168 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.649 ' HG3' ' N ' ' A' ' 46' ' ' LYS . 14.1 ptt180 -52.37 -49.34 64.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.991 -0.55 . . . . 74.450000000000003 111.519 -178.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.649 ' N ' ' HG3' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -82.2 -43.7 17.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.867 -0.606 . . . . 71.329999999999998 109.854 -175.513 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.743 ' HG3' ' HD3' ' A' ' 43' ' ' LYS . 10.9 mm-40 -60.91 -18.0 54.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.378 -0.828 . . . . 73.310000000000002 111.688 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.24 36.24 24.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.924 -0.655 . . . . 75.150000000000006 111.522 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.762 ' HE2' ' HA ' ' A' ' 49' ' ' LYS . 9.8 mmpt? -108.65 -10.25 15.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 71.5 110.066 -177.08 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.661 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 11.0 mt -75.38 142.6 75.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 74.109999999999999 111.226 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -70.92 137.92 33.06 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.745 2.296 . . . . 74.140000000000001 110.947 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.585 ' HA ' ' CG ' ' A' ' 55' ' ' ARG . 74.3 m-20 -63.82 -22.49 66.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.613 -0.721 . . . . 75.209999999999994 111.965 -177.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.764 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 20.2 m-20 -64.27 -52.74 57.18 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.445 -0.576 . . . . 64.329999999999998 109.445 179.179 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -63.8 -47.12 82.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.662 -0.699 . . . . 63.340000000000003 111.295 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.585 ' CG ' ' HA ' ' A' ' 52' ' ' ASN . 7.7 ppt_? -65.51 -23.65 66.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.003 0.43 . . . . 73.219999999999999 110.539 -175.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.6 tp -82.35 -37.43 25.68 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.816 -0.438 . . . . 62.200000000000003 109.816 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 41.4 mt -66.39 -43.75 84.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 73.200000000000003 110.538 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.407 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 94.7 mt -64.32 -44.07 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.128 -0.487 . . . . 54.229999999999997 110.621 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -68.88 -20.39 64.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.17 0.51 . . . . 75.109999999999999 110.353 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -79.55 -39.73 31.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.802 -0.635 . . . . 75.239999999999995 110.767 177.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.567 ' HB ' HG11 ' A' ' 20' ' ' VAL . 19.4 pt -80.99 -9.8 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.662 0.268 . . . . 72.030000000000001 111.366 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.76 6.44 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.624 -0.798 . . . . 43.049999999999997 112.816 175.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.407 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 85.6 t80 -84.07 120.48 26.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.09 0.471 . . . . 71.5 110.309 179.084 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 15.0 p -77.42 131.14 35.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.34 -0.845 . . . . 62.409999999999997 110.068 178.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.495 ' CZ2' ' HA ' ' A' ' 55' ' ' ARG . 94.6 m95 -90.2 -19.35 24.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.196 -0.456 . . . . 74.409999999999997 112.138 -173.401 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.7 m 62.81 26.95 15.85 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 122.065 0.936 . . . . 74.510000000000005 109.031 -172.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 47.3 tp -138.8 159.22 42.64 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.359 -1.292 . . . . 73.099999999999994 108.006 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.22 100.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.103 0.478 . . . . 72.400000000000006 111.522 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -77.82 79.59 4.3 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.681 -0.859 . . . . 64.129999999999995 108.681 174.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -131.67 -64.42 0.79 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.657 -0.701 . . . . 71.129999999999995 110.533 -175.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.4 t-80 68.57 150.11 0.07 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 124.071 0.857 . . . . 74.430000000000007 109.593 -173.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -74.24 81.44 1.83 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.49 0.662 . . . . 73.239999999999995 111.058 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -98.7 -15.32 19.42 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.371 -0.831 . . . . 62.130000000000003 108.815 174.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 61.6 t60 . . . . . 0 C--O 1.244 0.792 0 CA-C-N 114.76 -1.109 . . . . 71.239999999999995 109.089 178.818 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.879 -0.415 . . . . 73.049999999999997 109.879 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -110.03 103.94 12.75 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.806 -0.442 . . . . 72.439999999999998 109.806 176.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -74.08 115.99 14.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.235 0.541 . . . . 74.109999999999999 110.844 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -126.97 -157.75 0.83 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.66 -0.7 . . . . 53.509999999999998 109.149 179.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 tt -89.58 77.53 7.19 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.92 -0.77 . . . . 72.540000000000006 108.92 175.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.504 ' NE2' ' H ' ' A' ' 6' ' ' GLN . 0.6 OUTLIER -116.19 131.34 56.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.15 0.5 . . . . 61.009999999999998 110.218 177.787 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -84.34 50.84 4.47 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.746 -0.661 . . . . 74.310000000000002 112.551 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.73 -14.29 61.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.131 -0.322 . . . . 43.219999999999999 110.131 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.477 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 11.7 t-105 -57.52 -46.46 83.79 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 121.298 0.57 . . . . 60.030000000000001 109.981 173.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.542 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 15.2 mmt -66.1 -23.95 66.6 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.967 -0.561 . . . . 64.140000000000001 110.791 177.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 -51.49 9.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.065 -0.516 . . . . 74.109999999999999 110.379 179.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -78.1 -25.22 47.44 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.579 0.585 . . . . 71.329999999999998 112.579 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -62.46 -52.51 63.22 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 121.096 -0.242 . . . . 73.239999999999995 110.727 177.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 10' ' ' MET . 8.4 pt-20 -68.45 -25.26 64.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.349 0.595 . . . . 74.450000000000003 110.157 177.397 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' O ' HD11 ' A' ' 34' ' ' LEU . 12.2 tt0 -68.66 -31.83 71.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.363 -0.835 . . . . 70.349999999999994 109.844 178.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.559 HD22 ' CZ3' ' A' ' 37' ' ' TRP . 41.2 tp -88.81 -39.27 14.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.312 0.577 . . . . 75.120000000000005 109.571 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.472 ' HG3' HG21 ' A' ' 61' ' ' ILE . 59.2 tttm -53.29 -51.85 60.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.888 -1.051 . . . . 65.439999999999998 111.284 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.6 p -61.14 -33.53 73.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.68 -0.691 . . . . 43.409999999999997 111.463 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.555 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 14.5 t80 -75.38 -49.67 18.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.847 0.356 . . . . 75.129999999999995 110.389 -178.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.9 t -63.17 -36.18 74.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.177 -0.465 . . . . 63.420000000000002 110.666 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -53.83 -30.39 45.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.07 -0.514 . . . . 72.540000000000006 110.954 178.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -92.33 -56.03 3.19 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.879 -0.6 . . . . 73.140000000000001 112.042 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.94 -29.15 11.6 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 120.874 0.369 . . . . 65.540000000000006 111.113 -171.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.58 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.1 OUTLIER 62.3 104.28 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.218 -0.901 . . . . 71.129999999999995 110.192 -164.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.5 mmt180 77.79 153.3 0.14 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.572 -1.195 . . . . 73.409999999999997 111.625 -177.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.555 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 6.5 p90 -132.09 88.38 41.04 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 114.627 -1.169 . . . . 55.420000000000002 109.054 177.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.34 70.89 0.43 Allowed 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 122.82 2.347 . . . . 73.340000000000003 112.278 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.1 mttm 62.84 38.51 11.48 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.582 -0.735 . . . . 70.030000000000001 110.165 179.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.1 m -57.75 -74.93 0.05 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.263 -0.881 . . . . 72.420000000000002 111.935 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.5 p -112.48 -35.66 5.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.006 0.432 . . . . 73.120000000000005 110.525 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.972 ' HA ' ' HA3' ' A' ' 35' ' ' GLY . 41.3 mt-10 57.59 34.33 24.41 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.434 -0.803 . . . . 72.549999999999997 111.995 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -82.01 -104.86 0.4 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.427 -0.892 . . . . 72.439999999999998 111.322 173.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -62.88 -55.92 21.85 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.329 0.585 . . . . 71.329999999999998 110.948 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.414 HD13 HD12 ' A' ' 16' ' ' LEU . 98.2 mt -74.37 -32.08 62.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.37 -0.832 . . . . 71.010000000000005 111.104 -174.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.972 ' HA3' ' HA ' ' A' ' 31' ' ' GLU . . . -61.19 -43.57 99.23 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.335 -0.936 . . . . 64.010000000000005 111.218 177.032 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.37 -30.73 66.61 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 110.986 -0.845 . . . . 50.310000000000002 110.986 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.719 ' O ' HG22 ' A' ' 40' ' ' THR . 2.1 t90 -63.79 -46.44 85.17 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.441 -0.577 . . . . 74.430000000000007 109.441 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.486 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.3 t -60.1 -45.42 93.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.089 -0.505 . . . . 73.540000000000006 110.324 176.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.423 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 74.4 m-70 -61.52 -32.43 72.48 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.277 -0.419 . . . . 65.510000000000005 111.988 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 37' ' ' TRP . 1.3 t -71.05 -39.28 72.36 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 120.438 -0.505 . . . . 52.229999999999997 110.049 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.18 -27.57 61.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.859 0.361 . . . . 51.009999999999998 110.646 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 39' ' ' HIS . 21.3 tpt180 -54.98 -44.23 74.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.67 -0.695 . . . . 70.209999999999994 109.435 171.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 40' ' ' THR . 20.7 mtpp -71.79 -57.03 4.7 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.09 -0.959 . . . . 70.239999999999995 110.406 177.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.712 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.0 mmt -54.63 -33.99 61.42 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.808 -0.633 . . . . 71.049999999999997 111.973 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.861 ' HB2' HD12 ' A' ' 50' ' ' LEU . 23.9 tpt180 -74.14 -47.98 32.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.738 0.304 . . . . 65.140000000000001 110.334 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.479 ' HB3' ' HE2' ' A' ' 46' ' ' LYS . 5.1 tmmm? -64.99 -29.95 70.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.173 0.511 . . . . 72.540000000000006 110.162 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -79.23 -20.72 47.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.843 -0.617 . . . . 74.0 110.647 176.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 77.34 49.76 7.17 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.684 -0.689 . . . . 43.210000000000001 113.165 176.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.63 ' HD2' ' SD ' ' A' ' 44' ' ' MET . 0.1 OUTLIER -143.32 11.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.951 0.405 . . . . 61.310000000000002 111.915 177.678 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.861 HD12 ' HB2' ' A' ' 45' ' ' ARG . 5.7 mt -69.78 140.97 89.46 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.06 -0.518 . . . . 71.349999999999994 110.329 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.504 ' HD2' ' CD2' ' A' ' 50' ' ' LEU . 76.8 Cg_endo -80.63 144.92 16.0 Favored 'Trans proline' 0 C--O 1.239 0.535 0 C-N-CA 122.805 2.336 . . . . 73.439999999999998 113.047 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -65.5 -44.72 86.16 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.846 -1.07 . . . . 70.540000000000006 111.749 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.701 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 8.6 m-20 -54.78 -52.5 62.4 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.313 -0.403 . . . . 74.549999999999997 111.528 -175.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.558 ' HB3' HH11 ' A' ' 54' ' ' ARG . 3.1 ttp-105 -57.01 -46.0 82.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 65.310000000000002 110.697 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.72 -50.15 69.02 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.041 -0.981 . . . . 73.019999999999996 109.968 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.1 tp -67.64 -34.38 76.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 55.420000000000002 111.618 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.4 mt -62.61 -31.86 72.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 75.299999999999997 110.874 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt -71.67 -36.98 70.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.065 0.46 . . . . 75.430000000000007 110.443 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.22 -33.93 72.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.211 -0.449 . . . . 72.310000000000002 110.545 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -69.42 -31.78 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 71.019999999999996 111.881 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 17' ' ' LYS . 38.9 pt -86.81 -7.13 10.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.653 -0.419 . . . . 74.209999999999994 110.903 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.21 22.81 12.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.659 -0.782 . . . . 71.150000000000006 112.77 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -82.9 108.12 16.0 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.246 0.546 . . . . 74.530000000000001 110.104 178.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.1 p -78.89 142.6 13.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 73.239999999999995 110.641 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.494 ' HA ' HH21 ' A' ' 25' ' ' ARG . 94.6 m95 -98.28 -36.5 9.99 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.43 -0.35 . . . . 74.209999999999994 110.288 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.7 t 64.29 -166.03 0.23 Allowed 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.841 0.713 . . . . 53.109999999999999 110.529 178.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.3 mp -119.59 148.04 43.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.566 -0.288 . . . . 70.420000000000002 110.495 -177.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.495 ' HG2' ' N ' ' A' ' 69' ' ' HIS . 29.4 tt0 -153.9 157.98 40.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.106 -0.497 . . . . 73.409999999999997 110.28 -179.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.495 ' N ' ' HG2' ' A' ' 68' ' ' GLU . 28.8 m170 68.08 20.0 9.12 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.125 0.57 . . . . 74.239999999999995 111.878 173.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -118.87 155.07 31.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.56 -0.533 . . . . 54.200000000000003 109.56 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -174.1 -51.84 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.933 -0.766 . . . . 64.140000000000001 108.933 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -172.91 -39.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.451 -0.795 . . . . 74.420000000000002 109.627 173.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -84.93 166.68 16.6 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.658 -0.497 . . . . 73.25 109.658 174.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 11.6 p80 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.394 -0.812 . . . . 75.439999999999998 110.284 -179.765 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 110.107 -0.331 . . . . 73.049999999999997 110.107 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -128.39 112.47 14.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.178 -0.464 . . . . 73.049999999999997 110.063 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -116.84 14.54 15.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.97 0.414 . . . . 75.109999999999999 111.035 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -98.29 -19.86 17.56 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.85 -0.796 . . . . 74.420000000000002 108.85 172.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.1 mt -133.94 124.28 26.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.656 -1.156 . . . . 61.210000000000001 108.928 174.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -74.41 -50.03 20.12 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.943 0.401 . . . . 55.43 110.142 -176.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -97.84 39.45 2.77 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.783 -0.722 . . . . 61.219999999999999 112.004 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.475 ' OE2' ' HB3' ' A' ' 12' ' ' ASN . 4.2 tm-20 -66.47 -39.21 88.68 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.881 -0.414 . . . . 75.439999999999998 109.881 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.649 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 18.5 t-105 -51.82 -57.03 10.5 Favored 'General case' 0 C--N 1.334 -0.105 0 O-C-N 123.513 0.508 . . . . 75.040000000000006 111.278 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 45.2 ttm -58.25 -35.02 71.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.748 0.309 . . . . 73.200000000000003 110.875 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.6 tmmt? -69.36 -55.47 10.29 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.187 -0.46 . . . . 74.040000000000006 110.921 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.475 ' HB3' ' OE2' ' A' ' 8' ' ' GLU . 1.1 p-10 -66.09 -32.69 74.29 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 120.513 -0.475 . . . . 75.230000000000004 111.206 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.592 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 36.3 t80 -63.71 -45.75 88.56 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.279 . . . . 74.329999999999998 110.672 -179.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.496 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 38.7 mm-40 -58.97 -35.1 72.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.812 0.339 . . . . 71.25 111.287 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -75.45 -40.03 58.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.257 0.551 . . . . 72.540000000000006 110.041 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.441 HD13 HD22 ' A' ' 34' ' ' LEU . 47.0 tp -64.5 -40.25 95.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.281 -0.872 . . . . 73.329999999999998 111.597 -178.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 13' ' ' TYR . 55.2 mtpt -51.32 -57.71 8.16 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.348 0.594 . . . . 65.510000000000005 110.388 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.1 m -63.06 -37.05 85.63 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.915 -1.039 . . . . 54.420000000000002 111.336 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.534 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 11.2 t80 -65.73 -47.16 76.27 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.932 0.396 . . . . 74.340000000000003 110.621 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 40.2 t -67.76 -34.37 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.207 -0.451 . . . . 72.420000000000002 111.193 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -69.76 -39.83 76.48 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 120.928 -0.309 . . . . 74.519999999999996 110.367 178.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.67 -52.59 11.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.391 . . . . 73.150000000000006 111.406 -174.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -96.31 -20.82 18.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.017 0.377 . . . . 74.349999999999994 112.017 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.624 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 18.8 mmt180 63.47 92.99 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 72.239999999999995 110.158 -169.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 15.1 ptt-85 61.18 169.84 0.1 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.542 -1.208 . . . . 74.010000000000005 111.298 -176.015 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.808 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.8 p90 -141.04 86.65 11.34 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-O 121.517 0.675 . . . . 74.239999999999995 110.754 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -71.23 -39.51 3.86 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.116 2.544 . . . . 74.450000000000003 113.02 -175.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -115.71 5.53 14.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.805 0.336 . . . . 71.209999999999994 111.303 -174.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.808 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 13.8 m -87.82 114.87 24.84 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.094 0.473 . . . . 75.120000000000005 110.747 -177.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.564 ' HA ' ' CA ' ' A' ' 35' ' ' GLY . 13.1 t -119.09 23.52 11.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.518 0.675 . . . . 70.129999999999995 110.186 -179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -72.81 139.0 46.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.307 -0.86 . . . . 73.420000000000002 111.808 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 57.54 -152.44 26.33 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.388 -0.823 . . . . 74.049999999999997 113.572 174.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.414 ' O ' ' HB2' ' A' ' 37' ' ' TRP . 5.3 p30 -69.81 -27.84 65.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.82 -0.19 . . . . 71.209999999999994 110.769 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.441 HD22 HD13 ' A' ' 16' ' ' LEU . 81.1 mt -61.4 -38.93 88.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.816 0.341 . . . . 61.210000000000001 110.914 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.564 ' CA ' ' HA ' ' A' ' 30' ' ' THR . . . -58.72 -42.97 96.63 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.895 -0.669 . . . . 72.040000000000006 112.358 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -82.21 -26.71 47.16 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.275 -0.964 . . . . 53.240000000000002 111.293 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 5.2 t90 -56.58 -56.43 21.47 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 122.951 0.5 . . . . 72.310000000000002 110.584 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.7 p -65.09 -37.06 86.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.839 -0.619 . . . . 72.340000000000003 111.579 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.448 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 24.1 m80 -73.62 -40.46 63.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 74.450000000000003 111.908 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.527 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 95.9 m -63.65 -38.07 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.006 0.431 . . . . 74.530000000000001 110.966 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.971 ' HG2' HD21 ' A' ' 50' ' ' LEU . 7.9 mt-30 -76.55 -9.62 58.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.237 -0.438 . . . . 64.140000000000001 112.089 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 39' ' ' HIS . 5.1 mpt_? -62.41 -38.98 91.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.658 -0.497 . . . . 75.430000000000007 109.658 171.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.527 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -72.37 -37.37 68.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.635 -0.711 . . . . 73.519999999999996 110.34 179.189 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.481 ' CB ' ' HG ' ' A' ' 50' ' ' LEU . 16.9 mmt -71.32 -34.81 70.9 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 52.0 110.635 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.2 ttt-85 -63.89 -45.27 90.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.45 0.643 . . . . 63.219999999999999 109.635 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.6 tttp -61.93 -49.09 77.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.541 -1.209 . . . . 61.119999999999997 111.146 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -63.77 -31.07 72.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.703 -0.68 . . . . 60.439999999999998 110.352 177.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.89 32.24 15.41 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.745 -0.661 . . . . 71.129999999999995 112.712 176.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 49' ' ' LYS . 12.5 ptmt -121.98 7.16 9.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.792 0.329 . . . . 61.240000000000002 111.025 -178.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.971 HD21 ' HG2' ' A' ' 41' ' ' GLN . 4.6 mt -60.02 138.81 90.99 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.825 -0.625 . . . . 72.140000000000001 110.656 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 32.3 Cg_exo -61.08 131.86 38.94 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.183 2.588 . . . . 74.319999999999993 112.965 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.411 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 8.0 t30 -72.18 -39.66 68.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.355 -0.838 . . . . 64.310000000000002 111.374 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.691 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 50.7 m-20 -58.29 -53.83 53.83 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.148 0.499 . . . . 64.140000000000001 110.069 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.543 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -59.44 -39.82 84.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.254 -0.884 . . . . 75.030000000000001 110.738 176.345 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.424 ' HA ' ' HZ2' ' A' ' 65' ' ' TRP . 11.4 ttt180 -55.85 -50.32 70.92 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.931 -0.577 . . . . 71.209999999999994 110.6 177.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -67.81 -36.24 80.06 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.467 -0.788 . . . . 75.230000000000004 110.548 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 59.4 mt -62.19 -33.59 74.84 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.259 -0.428 . . . . 75.010000000000005 110.822 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 54' ' ' ARG . 56.8 mt -71.47 -41.35 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.138 0.494 . . . . 73.299999999999997 110.377 178.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.96 -32.01 73.53 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.132 -0.485 . . . . 72.409999999999997 110.257 177.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -58.87 -47.64 84.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.879 -0.601 . . . . 65.120000000000005 111.668 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.57 HG21 ' HG2' ' A' ' 17' ' ' LYS . 30.2 pt -77.71 -9.72 12.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.839 0.352 . . . . 74.430000000000007 111.488 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.25 14.09 19.39 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.537 -0.839 . . . . 65.5 113.53 174.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -72.57 124.19 24.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.834 -0.432 . . . . 74.430000000000007 109.834 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.651 HG22 ' H ' ' A' ' 66' ' ' SER . 14.4 p -86.09 134.14 28.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.929 -0.578 . . . . 74.409999999999997 110.831 -176.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.424 ' HZ2' ' HA ' ' A' ' 55' ' ' ARG . 94.6 m95 -92.24 20.32 6.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.975 -0.557 . . . . 73.209999999999994 111.263 -178.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.651 ' H ' HG22 ' A' ' 64' ' ' VAL . 14.4 m 71.26 123.87 0.03 OUTLIER 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.223 -0.899 . . . . 62.329999999999998 112.135 174.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.4 mp -73.4 -173.73 1.47 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.88 -0.6 . . . . 75.409999999999997 109.484 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 59.06 75.01 0.42 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.341 -0.985 . . . . 72.040000000000006 108.341 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -118.96 117.78 29.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.037 -0.983 . . . . 71.420000000000002 110.675 -170.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -107.31 158.59 17.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.641 -0.254 . . . . 74.310000000000002 110.873 179.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 27.9 m80 -103.67 143.52 32.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.131 -0.486 . . . . 75.010000000000005 111.066 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -171.15 137.54 1.16 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.03 -0.729 . . . . 71.510000000000005 109.03 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -156.8 76.37 0.87 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.298 0.571 . . . . 75.349999999999994 111.95 -177.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.402 -0.809 . . . . 55.539999999999999 109.427 175.819 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.2 mtt . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 120.548 0.214 . . . . 64.209999999999994 110.823 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -67.88 -42.52 81.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.085 0.469 . . . . 74.400000000000006 110.184 174.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -138.19 144.47 40.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.735 -0.666 . . . . 75.200000000000003 109.881 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -117.68 -19.74 9.21 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.981 0.42 . . . . 74.319999999999993 110.463 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.8 mt -113.73 153.54 28.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.079 -0.51 . . . . 53.310000000000002 110.237 178.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 63.19 50.78 2.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.59 -0.732 . . . . 70.319999999999993 110.792 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -71.98 71.75 0.93 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.044 -0.598 . . . . 64.510000000000005 111.811 174.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -57.5 -26.21 60.97 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 122.973 0.509 . . . . 64.219999999999999 111.377 -176.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.485 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 2.9 t-105 -57.45 -42.2 82.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.113 -0.494 . . . . 73.209999999999994 111.057 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.459 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.9 tpt -59.18 -41.03 87.5 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.25 0.548 . . . . 32.210000000000001 110.572 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -70.27 -57.86 4.4 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.257 -0.883 . . . . 73.129999999999995 110.791 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -54.38 -32.0 56.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.989 -1.005 . . . . 71.340000000000003 111.241 -179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.659 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 63.8 t80 -58.41 -55.27 37.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.23 -0.441 . . . . 61.240000000000002 110.655 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.788 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 68.2 mm-40 -64.5 -36.73 85.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 64.129999999999995 111.204 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.15 -45.73 83.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.151 -0.477 . . . . 72.340000000000003 110.09 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.22 -40.08 93.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 64.409999999999997 110.95 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.788 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.7 mtpt -52.95 -58.85 5.58 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.931 0.396 . . . . 62.539999999999999 110.438 177.537 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.6 m -62.36 -36.34 81.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.227 -0.897 . . . . 74.239999999999995 111.414 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.672 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 18.9 t80 -63.16 -48.38 78.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 74.340000000000003 110.461 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.573 ' HA ' ' H ' ' A' ' 25' ' ' ARG . 64.6 t -71.8 -38.69 66.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.421 . . . . 52.100000000000001 110.562 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -55.82 -46.4 78.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.698 -0.683 . . . . 70.409999999999997 111.632 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.19 -48.84 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.306 0.484 . . . . 71.299999999999997 112.306 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -100.32 -15.93 17.85 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.026 0.38 . . . . 63.539999999999999 112.026 -170.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.536 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 6.8 mmt180 65.08 95.28 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.678 0.611 . . . . 73.349999999999994 111.519 -175.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.573 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 50.86 -172.74 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.657 1.183 . . . . 65.299999999999997 112.577 178.265 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.672 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 59.8 m-85 -73.11 143.78 84.08 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.08 -0.509 . . . . 55.210000000000001 110.78 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.78 -46.85 12.46 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 122.578 2.186 . . . . 73.019999999999996 111.221 174.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -161.12 38.96 0.15 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.914 -0.773 . . . . 72.0 108.914 174.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.1 m 68.18 -177.28 0.21 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.927 -1.033 . . . . 61.439999999999998 111.893 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 55.03 48.9 18.77 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.501 -0.772 . . . . 64.030000000000001 112.576 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -114.27 110.17 19.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.953 -0.567 . . . . 73.129999999999995 110.908 176.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.23 -145.56 41.21 Favored Glycine 0 C--O 1.235 0.214 0 CA-C-N 115.655 -0.702 . . . . 75.400000000000006 113.495 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -68.38 -34.22 75.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.582 0.706 . . . . 71.319999999999993 109.442 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.442 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 93.5 mt -59.74 -32.87 70.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.858 -1.065 . . . . 74.319999999999993 110.817 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.14 -39.47 97.18 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.019 -0.61 . . . . 75.109999999999999 112.143 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.6 -33.59 47.01 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.179 -0.768 . . . . 63.549999999999997 111.179 178.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.801 ' HZ2' ' HD3' ' A' ' 54' ' ' ARG . 38.0 t90 -58.94 -55.17 38.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.159 -0.52 . . . . 74.209999999999994 110.388 175.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.39 -43.0 99.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.257 -0.883 . . . . 60.240000000000002 111.428 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.31 -41.6 63.09 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.914 0.339 . . . . 75.439999999999998 111.914 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.5 m -73.98 -51.19 16.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.145 0.497 . . . . 72.340000000000003 111.407 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.623 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 30.4 mt-30 -85.71 -12.98 49.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.713 1.005 . . . . 73.010000000000005 113.713 -167.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.417 ' HD2' ' C ' ' A' ' 42' ' ' ARG . 6.2 ppt_? -64.59 -24.5 67.62 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.626 0.727 . . . . 75.140000000000001 109.544 173.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -78.77 -46.36 19.02 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.093 -0.958 . . . . 74.209999999999994 109.824 176.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.623 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 12.2 mmt -60.69 -31.03 70.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.542 -0.754 . . . . 64.400000000000006 110.512 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.427 ' HB2' HD12 ' A' ' 50' ' ' LEU . 23.5 tpt180 -59.11 -45.75 90.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.469 -0.787 . . . . 63.100000000000001 110.623 174.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.44 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 0.4 OUTLIER -71.33 -43.89 66.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.076 -0.511 . . . . 73.549999999999997 109.651 -179.058 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.437 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 51.7 mt-30 -65.63 -14.32 60.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.608 -0.724 . . . . 74.329999999999998 111.791 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.29 26.53 73.34 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.155 -0.545 . . . . 62.520000000000003 112.444 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.521 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.8 ptmt -110.35 -4.58 15.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.826 0.346 . . . . 52.229999999999997 111.001 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.592 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 3.9 mt -58.9 140.99 86.22 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.835 -0.62 . . . . 75.409999999999997 109.933 174.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 16.7 Cg_exo -69.81 131.26 20.79 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.881 2.387 . . . . 64.430000000000007 112.309 176.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.56 -33.97 72.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.399 -0.819 . . . . 73.540000000000006 111.001 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.721 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 19.1 m-20 -51.91 -53.46 40.64 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.483 0.658 . . . . 75.430000000000007 110.028 176.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.801 ' HD3' ' HZ2' ' A' ' 37' ' ' TRP . 33.1 ttm180 -68.14 -48.65 64.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.742 -1.117 . . . . 73.439999999999998 111.217 -179.248 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.46 ' HG2' ' CH2' ' A' ' 65' ' ' TRP . 3.6 tmt_? -50.22 -41.48 50.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.518 -0.765 . . . . 71.040000000000006 110.987 176.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.38 -36.14 73.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.559 0.218 . . . . 74.230000000000004 111.119 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 75.6 mt -61.81 -43.14 99.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 44.009999999999998 110.698 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.23 -39.15 86.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.839 -0.619 . . . . 73.409999999999997 111.159 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.94 -28.83 64.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.103 0.478 . . . . 71.120000000000005 110.253 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.46 ' C ' ' HD2' ' A' ' 60' ' ' LYS . 0.4 OUTLIER -66.9 -46.21 75.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.932 -0.576 . . . . 72.400000000000006 110.279 178.922 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.503 HG21 ' HG2' ' A' ' 17' ' ' LYS . 42.6 pt -72.9 -23.07 20.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.551 -0.295 . . . . 73.030000000000001 110.966 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.89 32.4 3.09 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.508 -0.853 . . . . 63.229999999999997 112.933 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -74.79 130.23 39.09 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.031 0.443 . . . . 72.140000000000001 110.29 177.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.502 HG22 ' H ' ' A' ' 66' ' ' SER . 10.6 p -76.13 134.07 29.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.684 -0.689 . . . . 65.439999999999998 110.1 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.46 ' CH2' ' HG2' ' A' ' 55' ' ' ARG . 95.9 m95 -89.75 -12.45 39.31 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.326 -0.397 . . . . 73.150000000000006 111.114 -177.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.502 ' H ' HG22 ' A' ' 64' ' ' VAL . 1.7 p -97.31 81.07 2.96 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.507 0.67 . . . . 74.209999999999994 110.79 176.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.668 HD23 ' HG3' ' A' ' 68' ' ' GLU . 5.3 tt -93.14 119.35 32.25 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.294 -1.002 . . . . 74.340000000000003 108.294 177.452 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.668 ' HG3' HD23 ' A' ' 67' ' ' LEU . 47.6 mt-10 62.2 -158.22 0.33 Allowed 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.475 0.484 . . . . 72.439999999999998 109.759 -172.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 75.2 m80 68.56 137.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.827 0.704 . . . . 72.329999999999998 111.98 175.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -151.1 118.1 5.88 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.854 -0.612 . . . . 71.329999999999998 110.57 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -107.87 138.19 44.55 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.302 -0.629 . . . . 71.340000000000003 109.302 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -70.67 111.76 6.39 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.194 0.521 . . . . 63.140000000000001 111.771 -176.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 -110.8 83.31 1.74 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.433 -0.951 . . . . 71.450000000000003 108.433 173.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 47.3 t60 . . . . . 0 C--O 1.247 0.921 0 CA-C-O 118.253 -0.88 . . . . 72.219999999999999 109.7 -174.911 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ttt . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.786 0.327 . . . . 71.010000000000005 110.469 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -73.86 135.51 43.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.297 -0.41 . . . . 73.239999999999995 110.289 177.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -76.35 105.39 7.38 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.15 0.5 . . . . 65.329999999999998 110.054 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -89.5 106.33 18.39 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.357 -0.838 . . . . 64.400000000000006 111.083 -176.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.41 ' HB3' ' H ' ' A' ' 6' ' ' GLN . 10.9 mp 59.25 -155.07 0.36 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.639 -0.709 . . . . 73.150000000000006 111.96 174.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.41 ' H ' ' HB3' ' A' ' 5' ' ' LEU . 10.4 pt20 -144.35 166.06 26.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.329 -0.851 . . . . 74.420000000000002 109.723 -178.311 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.23 42.2 4.68 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.57 -0.824 . . . . 42.039999999999999 111.358 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -63.3 -21.32 66.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.755 -0.223 . . . . 64.219999999999999 111.188 -177.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.512 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -56.34 -47.73 78.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.755 0.312 . . . . 54.0 110.296 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 tpt -55.37 -43.27 74.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 62.530000000000001 110.321 177.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -66.6 -44.22 82.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.182 -0.917 . . . . 62.299999999999997 110.366 -178.773 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -65.64 -33.04 74.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.236 0.541 . . . . 74.239999999999995 110.787 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.431 ' CE2' ' HD2' ' A' ' 17' ' ' LYS . 91.5 t80 -63.99 -53.48 49.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 73.519999999999996 110.901 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -63.16 -32.27 73.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.273 -0.421 . . . . 74.450000000000003 111.336 -176.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 47.7 mt-10 -63.69 -42.4 97.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.821 0.343 . . . . 74.129999999999995 110.979 177.269 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.467 HD23 ' O ' ' A' ' 16' ' ' LEU . 4.4 tt -79.51 -36.19 38.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.898 -0.778 . . . . 64.420000000000002 108.898 -174.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.431 ' HD2' ' CE2' ' A' ' 13' ' ' TYR . 61.1 tttm -53.75 -44.79 70.28 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.694 -1.139 . . . . 72.530000000000001 110.879 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 58.4 m -82.25 -32.95 29.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.851 -0.613 . . . . 71.010000000000005 111.33 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -64.83 -47.25 78.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.819 0.342 . . . . 71.010000000000005 110.921 -177.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.521 HG11 HD12 ' A' ' 61' ' ' ILE . 8.7 p -65.61 -33.77 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.274 -0.421 . . . . 72.310000000000002 110.511 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.76 -25.27 62.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.234 0.54 . . . . 61.329999999999998 109.9 179.564 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -93.17 -56.07 3.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.612 -0.722 . . . . 65.409999999999997 111.553 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -90.54 -15.93 29.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.159 -0.473 . . . . 75.510000000000005 111.567 -174.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 9.6 mmm180 58.34 88.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.878 0.736 . . . . 71.5 110.556 -174.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.518 ' HG2' ' N ' ' A' ' 26' ' ' PHE . 37.8 ttt-85 67.24 167.34 0.24 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.698 -1.137 . . . . 72.310000000000002 111.117 -176.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.518 ' N ' ' HG2' ' A' ' 25' ' ' ARG . 52.7 m-85 -78.76 144.93 65.5 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.075 -0.713 . . . . 74.340000000000003 109.075 174.111 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.431 ' HD2' ' OE1' ' A' ' 31' ' ' GLU . 52.2 Cg_exo -53.06 -50.84 12.63 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.288 1.992 . . . . 71.200000000000003 110.884 174.088 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -172.65 -47.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.542 -0.754 . . . . 73.109999999999999 109.778 173.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 77.9 p -178.39 -162.49 0.06 Allowed 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.219 -0.66 . . . . 53.450000000000003 109.219 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.17 20.15 11.9 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.306 0.574 . . . . 72.530000000000001 111.851 -178.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.431 ' OE1' ' HD2' ' A' ' 27' ' ' PRO . 1.0 OUTLIER -80.61 -172.93 3.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.15 -0.477 . . . . 63.240000000000002 109.893 171.851 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.84 -133.42 0.54 Allowed Glycine 0 CA--C 1.517 0.182 0 C-N-CA 120.697 -0.764 . . . . 75.340000000000003 112.155 177.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -60.96 -29.77 69.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.845 0.355 . . . . 60.020000000000003 110.784 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.474 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 82.4 mt -66.73 -30.94 71.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 72.349999999999994 110.803 176.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.54 -36.66 91.76 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.793 -0.923 . . . . 64.400000000000006 110.793 174.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.21 -38.12 63.26 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.173 -0.771 . . . . 70.030000000000001 111.173 174.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -56.27 -49.24 74.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.907 -0.405 . . . . 75.230000000000004 109.907 174.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.76 -51.26 70.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.622 -0.717 . . . . 72.140000000000001 110.635 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -56.71 -46.85 81.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 74.219999999999999 111.232 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.567 ' O ' ' HG2' ' A' ' 44' ' ' MET . 51.7 m -61.84 -42.58 99.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.222 -0.445 . . . . 72.129999999999995 110.926 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.78 -27.05 68.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 51.439999999999998 111.744 -175.006 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 42' ' ' ARG . 1.2 tmt_? -58.77 -36.99 75.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 71.400000000000006 110.217 177.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.438 ' CE ' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -84.07 -34.78 24.13 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.932 -0.307 . . . . 74.549999999999997 110.501 178.131 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.567 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.3 mmt -55.16 -38.94 68.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.269 -0.423 . . . . 74.209999999999994 111.413 -176.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.525 ' HB3' HD12 ' A' ' 50' ' ' LEU . 10.9 ptm180 -72.33 -34.5 68.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.728 0.299 . . . . 74.230000000000004 111.021 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.77 -30.41 59.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.231 -0.655 . . . . 73.319999999999993 109.231 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -77.25 -16.99 58.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.392 -0.822 . . . . 51.329999999999998 110.462 174.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 74.24 24.44 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.965 -0.561 . . . . 74.25 112.642 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' A' ' 49' ' ' LYS . 19.3 ptmt -109.13 -3.04 17.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.646 0.26 . . . . 54.020000000000003 111.455 -177.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.875 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -64.65 139.07 97.66 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.644 -0.502 . . . . 62.229999999999997 109.644 176.774 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.875 ' HD2' HD23 ' A' ' 50' ' ' LEU . 2.6 Cg_exo -78.56 124.22 6.28 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.678 2.252 . . . . 74.25 111.753 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -61.06 -31.14 70.8 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.612 -0.722 . . . . 41.009999999999998 109.835 175.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.727 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.2 m-20 -57.56 -52.39 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.495 -0.775 . . . . 65.230000000000004 109.671 174.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HG3' ' CH2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -67.42 -31.88 72.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 74.420000000000002 110.119 -178.866 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -60.9 -43.91 97.88 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.307 -0.627 . . . . 72.420000000000002 109.307 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 65.8 tp -72.48 -41.91 65.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.0 -0.546 . . . . 73.519999999999996 110.508 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 79.1 mt -58.03 -43.31 86.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.845 0.355 . . . . 73.439999999999998 110.466 177.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.676 HD12 HD11 ' A' ' 61' ' ' ILE . 21.2 tp -64.77 -44.56 89.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.675 -0.693 . . . . 53.240000000000002 110.403 -178.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -63.19 -38.01 89.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.156 -0.475 . . . . 72.5 110.322 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -70.84 -36.55 72.95 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.906 -0.588 . . . . 75.319999999999993 111.997 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.676 HD11 HD12 ' A' ' 58' ' ' LEU . 10.7 pt -74.56 -3.66 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.758 0.313 . . . . 54.530000000000001 111.75 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.6 20.06 8.37 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.311 -0.947 . . . . 43.520000000000003 113.497 173.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -87.54 119.72 28.11 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.199 0.523 . . . . 73.209999999999994 110.559 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.483 ' CG1' ' HD2' ' A' ' 25' ' ' ARG . 14.4 p -93.47 128.41 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 CA-C-N 115.473 -0.785 . . . . 42.210000000000001 110.293 177.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.475 ' CH2' HD23 ' A' ' 58' ' ' LEU . 42.0 m95 -80.78 -32.47 35.39 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.646 -0.706 . . . . 72.319999999999993 110.813 -174.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.7 m -73.58 128.68 36.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.85 -0.614 . . . . 65.25 110.843 -178.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.5 tp -88.91 127.77 35.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.019 -0.537 . . . . 62.350000000000001 110.64 -178.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 63.68 15.62 9.09 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.572 0.701 . . . . 71.409999999999997 111.004 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -101.69 50.69 0.84 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.545 0.688 . . . . 71.430000000000007 109.856 177.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -66.23 117.74 8.95 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.009 -0.996 . . . . 64.310000000000002 109.847 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -64.76 125.14 23.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.338 -0.392 . . . . 72.140000000000001 111.141 -173.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -138.2 92.8 2.68 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.929 -0.578 . . . . 71.430000000000007 110.457 174.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -75.98 -18.04 59.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.401 0.619 . . . . 74.439999999999998 109.637 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 117.835 -1.079 . . . . 75.340000000000003 108.514 174.788 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptt? . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 110.281 -0.266 . . . . 74.349999999999994 110.281 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -144.24 147.58 33.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.933 0.397 . . . . 71.340000000000003 110.355 177.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -161.84 98.61 1.09 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.703 -0.851 . . . . 70.140000000000001 108.703 179.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -59.95 149.37 32.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.287 0.565 . . . . 42.229999999999997 111.896 -175.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.0 tp -71.26 137.21 48.41 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.335 -0.848 . . . . 73.329999999999998 109.34 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -73.62 96.0 2.4 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.99 0.424 . . . . 74.129999999999995 110.442 -177.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.81 136.64 22.13 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.525 -1.03 . . . . 52.43 110.525 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -26.69 65.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 117.05 0.425 . . . . 53.030000000000001 110.623 -174.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 7.3 t-105 -58.63 -51.3 70.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.707 -0.224 . . . . 70.510000000000005 111.199 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.459 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -59.84 -31.2 69.52 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.119 0.485 . . . . 52.5 110.381 -179.193 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.68 -48.24 15.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.924 -0.58 . . . . 73.150000000000006 110.058 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -65.28 -32.89 74.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 116.326 -0.397 . . . . 73.329999999999998 111.792 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -65.77 -53.31 42.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.822 0.344 . . . . 73.439999999999998 110.195 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.738 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 65.3 mm-40 -61.21 -31.98 71.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.302 0.572 . . . . 74.25 110.032 176.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.21 -52.24 63.06 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.081 -0.963 . . . . 74.540000000000006 110.095 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.4 tp -61.04 -44.72 96.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.725 -0.671 . . . . 70.209999999999994 111.133 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.738 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.9 mtpt -51.49 -58.42 6.32 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.501 0.667 . . . . 54.329999999999998 109.881 176.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.9 m -61.79 -42.53 99.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.562 -1.199 . . . . 73.140000000000001 111.838 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.473 ' CE2' ' HB3' ' A' ' 26' ' ' PHE . 26.4 t80 -67.18 -46.59 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.63 0.252 . . . . 64.049999999999997 110.799 -176.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 t -66.46 -39.38 83.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.957 -0.297 . . . . 73.340000000000003 110.678 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -60.94 -25.71 66.98 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.007 0.432 . . . . 71.530000000000001 110.203 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -92.77 -58.34 2.38 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.257 -0.429 . . . . 75.109999999999999 112.141 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -100.81 -30.04 11.92 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.207 0.447 . . . . 44.219999999999999 112.207 -170.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.3 OUTLIER 64.27 94.65 0.05 Allowed 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 123.846 0.716 . . . . 71.340000000000003 110.461 -168.379 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.2 mmm180 75.61 168.31 0.27 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 114.316 -1.311 . . . . 73.019999999999996 111.185 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.546 ' CZ ' ' HB3' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -132.34 84.61 51.41 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.523 -0.762 . . . . 75.409999999999997 110.067 177.636 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.62 132.45 35.43 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.647 2.232 . . . . 65.340000000000003 111.614 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.1 tttt 66.11 27.14 10.57 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.47 0.652 . . . . 74.200000000000003 109.45 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 52.2 p 49.9 68.45 0.74 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 114.924 -1.035 . . . . 64.519999999999996 111.615 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.55 -35.23 75.52 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.46 -0.791 . . . . 63.240000000000002 111.031 178.312 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.473 ' HG2' HD23 ' A' ' 34' ' ' LEU . 11.3 tp10 -112.85 121.64 45.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.858 -0.61 . . . . 45.43 109.493 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.63 -34.64 90.43 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.005 -0.617 . . . . 75.150000000000006 112.489 -178.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -60.5 -55.12 37.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.931 0.396 . . . . 71.430000000000007 111.183 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 26' ' ' PHE . 3.6 mm? -74.37 -26.68 60.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.143 -0.48 . . . . 75.109999999999999 110.709 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.88 97.74 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.61 -0.596 . . . . 70.25 111.61 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.57 -35.62 75.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.866 -0.683 . . . . 73.230000000000004 111.479 176.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -60.04 -49.81 76.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 74.209999999999994 109.946 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.1 m -70.33 -33.23 71.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.739 -0.664 . . . . 75.340000000000003 111.928 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -53.42 -37.08 62.21 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.799 0.333 . . . . 73.340000000000003 111.309 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 39.7 m -77.95 -44.55 26.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.893 -0.594 . . . . 62.420000000000002 111.369 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 27.8 mt-30 -84.84 -19.23 32.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.43 0.9 . . . . 61.409999999999997 113.43 -170.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.65 -26.75 68.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.126 0.489 . . . . 73.030000000000001 109.936 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -70.55 -45.48 65.39 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.526 -0.761 . . . . 65.219999999999999 109.631 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.791 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.5 mmt -65.94 -33.51 75.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.766 -0.652 . . . . 73.310000000000002 110.774 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.649 ' HB2' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -68.43 -47.05 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 73.510000000000005 110.082 178.76 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.406 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 0.3 OUTLIER -63.54 -45.65 89.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.784 -0.643 . . . . 75.099999999999994 109.444 179.819 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.488 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 1.2 tp-100 -67.6 -31.01 70.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 72.540000000000006 110.909 -178.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.84 41.24 4.73 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.206 -0.521 . . . . 75.400000000000006 113.385 174.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HE2' ' HB3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -131.96 2.62 4.01 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 117.212 0.506 . . . . 64.030000000000001 111.455 177.654 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.791 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 5.1 mt -54.24 140.0 54.96 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.721 -0.392 . . . . 71.510000000000005 110.434 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.6 140.52 81.7 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 123.262 2.641 . . . . 73.439999999999998 113.002 178.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.485 ' O ' ' HG3' ' A' ' 55' ' ' ARG . 18.1 m120 -64.3 -29.05 70.15 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.057 -0.974 . . . . 74.329999999999998 110.754 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -70.26 -44.27 68.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.066 0.46 . . . . 74.019999999999996 109.828 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.447 ' HD3' ' HA ' ' A' ' 54' ' ' ARG . 26.5 mmt180 -59.17 -51.8 68.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 71.25 110.987 177.314 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -66.02 -27.58 68.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.314 -0.403 . . . . 74.329999999999998 110.452 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.32 -44.2 30.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.711 0.291 . . . . 72.409999999999997 110.503 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.1 tp -59.46 -45.89 90.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.977 -0.556 . . . . 71.219999999999999 110.822 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.532 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 10.5 mp -66.05 -45.0 82.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.903 -0.589 . . . . 50.420000000000002 110.472 178.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.12 -28.25 69.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.287 0.565 . . . . 65.430000000000007 110.56 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -53.55 19.3 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 115.792 -0.64 . . . . 54.140000000000001 110.959 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.0 pt -68.49 -19.86 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.682 0.277 . . . . 40.25 111.728 -176.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.98 22.72 4.14 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.591 -0.814 . . . . 65.239999999999995 112.601 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.532 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 45.3 t80 -83.78 103.7 13.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.416 0.627 . . . . 70.209999999999994 109.723 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -82.62 151.74 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 CA-C-N 115.059 -0.973 . . . . 73.25 110.044 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -93.81 25.95 3.37 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.764 0.316 . . . . 73.0 110.81 -175.023 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 m -71.18 95.78 1.3 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.443 0.639 . . . . 54.25 110.66 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.5 pp -144.38 155.2 43.67 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.347 -0.842 . . . . 62.399999999999999 109.144 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -103.71 120.08 40.2 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.21 0.529 . . . . 75.010000000000005 111.178 -176.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -161.44 112.53 1.73 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.35 -0.841 . . . . 61.509999999999998 109.47 178.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -60.66 130.29 45.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.18 -0.464 . . . . 64.239999999999995 110.532 -178.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -105.09 123.65 48.18 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.334 -0.617 . . . . 64.420000000000002 109.334 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -117.04 134.95 54.11 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.329 -0.396 . . . . 74.209999999999994 110.7 -173.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -145.15 151.56 38.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.732 0.301 . . . . 73.219999999999999 111.28 176.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 3.9 m80 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.571 -0.728 . . . . 71.0 109.671 172.226 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 120.702 0.286 . . . . 72.439999999999998 110.324 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -134.34 104.39 6.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.124 0.488 . . . . 71.040000000000006 110.562 176.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -119.47 -23.3 6.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.644 -0.707 . . . . 73.510000000000005 109.658 175.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -118.12 149.0 41.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.779 -0.646 . . . . 51.039999999999999 110.345 -178.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.1 mp 60.13 45.41 11.79 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.913 0.863 . . . . 70.209999999999994 110.116 -178.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -74.56 -169.88 0.93 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.394 -1.275 . . . . 73.030000000000001 110.572 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.0 54.72 3.07 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.999 -0.62 . . . . 54.340000000000003 112.039 176.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -76.08 -33.15 59.52 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.509 -0.552 . . . . 63.409999999999997 109.509 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.563 ' HZ3' ' HZ2' ' A' ' 37' ' ' TRP . 25.6 t-105 -48.79 -50.58 33.54 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.1 -0.955 . . . . 74.219999999999999 112.584 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.514 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.4 tpt -53.69 -39.03 64.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.235 0.54 . . . . 74.319999999999993 110.63 -177.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HE2' ' HB3' ' A' ' 11' ' ' LYS . 4.5 tmmm? -75.42 -41.93 54.76 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.637 -0.71 . . . . 72.439999999999998 110.199 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -59.0 -38.8 80.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.831 -0.622 . . . . 65.219999999999999 111.092 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -60.93 -48.18 83.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 74.450000000000003 110.371 177.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.664 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 70.6 mm-40 -64.68 -38.97 92.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 71.140000000000001 110.697 178.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -60.28 -45.2 94.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.887 -0.597 . . . . 72.329999999999998 109.692 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.5 ' HA ' HD11 ' A' ' 34' ' ' LEU . 33.0 tp -58.95 -47.34 85.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 72.310000000000002 110.946 178.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.664 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.3 mtpt -54.99 -55.73 27.65 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.22 0.533 . . . . 71.530000000000001 110.765 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.8 t -55.74 -47.26 77.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.204 -0.907 . . . . 52.100000000000001 111.069 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.56 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 42.2 t80 -65.26 -46.78 79.13 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.274 -0.421 . . . . 74.109999999999999 111.292 -176.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.556 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 9.4 p -68.09 -32.56 56.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-N 116.311 -0.404 . . . . 62.43 110.896 -178.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.482 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.6 tmt_? -70.94 -19.08 62.61 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.199 0.524 . . . . 74.030000000000001 110.179 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -85.16 -61.51 1.75 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.939 -0.573 . . . . 65.519999999999996 111.445 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -97.13 -19.0 18.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.767 0.318 . . . . 73.129999999999995 110.777 -176.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.556 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER 60.81 93.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 65.340000000000003 110.546 -168.36 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' H ' HG23 ' A' ' 20' ' ' VAL . 63.0 ttt180 65.21 158.64 0.1 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.445 -1.252 . . . . 73.109999999999999 112.184 -172.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.56 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 11.2 p90 -119.36 143.76 35.08 Favored Pre-proline 0 C--N 1.317 -0.829 0 CA-C-N 114.583 -1.19 . . . . 75.219999999999999 109.387 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 26' ' ' PHE . 3.5 Cg_exo -74.79 -54.44 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.512 2.141 . . . . 65.019999999999996 111.369 178.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -152.29 99.04 2.47 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.382 -0.97 . . . . 74.109999999999999 108.382 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.4 t -105.56 137.0 44.13 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.37 0.605 . . . . 73.310000000000002 112.079 -170.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -130.66 23.31 5.05 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.921 -1.036 . . . . 74.439999999999998 109.489 170.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -84.92 86.33 7.38 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.37 -0.832 . . . . 64.200000000000003 111.11 -176.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 50.06 -108.67 0.52 Allowed Glycine 0 C--N 1.331 0.302 0 CA-C-N 115.548 -0.751 . . . . 65.019999999999996 114.201 173.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -63.44 -44.71 93.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.207 -0.497 . . . . 51.329999999999998 111.055 -174.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.5 HD11 ' HA ' ' A' ' 16' ' ' LEU . 3.1 mm? -75.13 -24.9 58.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.947 -0.569 . . . . 51.009999999999998 110.26 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.49 -36.16 92.77 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.658 -0.701 . . . . 34.130000000000003 112.022 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.42 -36.45 49.66 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.564 -0.827 . . . . 61.030000000000001 111.661 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.563 ' HZ2' ' HZ3' ' A' ' 9' ' ' TRP . 3.7 m95 -58.91 -49.88 76.14 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.032 0.444 . . . . 71.010000000000005 110.596 175.674 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -61.18 -40.21 93.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.314 -0.857 . . . . 73.310000000000002 111.174 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -69.8 -46.66 65.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.144 0.424 . . . . 61.240000000000002 112.144 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.467 ' O ' ' HG2' ' A' ' 44' ' ' MET . 49.0 m -80.99 -57.52 3.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.429 0.529 . . . . 35.310000000000002 112.429 -172.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.13 -18.46 49.75 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.535 0.939 . . . . 73.349999999999994 113.535 -166.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 42' ' ' ARG . 5.4 tmm_? -65.23 -32.12 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.194 0.521 . . . . 64.310000000000002 109.821 176.399 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.0 ttmm -76.51 -46.05 28.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.734 -0.666 . . . . 54.310000000000002 110.551 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.542 ' HB3' ' HG3' ' A' ' 49' ' ' LYS . 11.6 mmt -59.92 -28.75 67.87 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.54 -0.755 . . . . 71.340000000000003 111.273 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 ttt180 -64.88 -48.94 72.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.032 0.444 . . . . 73.140000000000001 110.463 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.502 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 3.3 tmmm? -65.76 -34.7 78.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.354 0.597 . . . . 54.350000000000001 109.619 -179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -83.74 1.03 44.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.518 -0.764 . . . . 63.140000000000001 111.704 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 59.25 34.45 80.15 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 116.356 -0.384 . . . . 72.019999999999996 113.232 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 17.9 ptmt -119.21 1.9 11.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.161 0.505 . . . . 70.420000000000002 110.967 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 mt -61.77 142.22 94.83 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.325 -0.852 . . . . 61.43 110.113 172.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.529 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 26.0 Cg_exo -64.65 120.69 8.03 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.177 1.918 . . . . 75.010000000000005 111.038 169.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -56.58 -32.86 65.63 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.98 -0.555 . . . . 73.310000000000002 110.42 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -58.31 -41.3 84.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 61.329999999999998 110.57 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.529 ' HG2' ' HB2' ' A' ' 51' ' ' PRO . 18.7 mmt180 -62.1 -50.2 72.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 116.088 -0.506 . . . . 74.439999999999998 110.799 179.549 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -54.24 -37.81 65.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.778 -0.646 . . . . 72.349999999999994 110.521 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 tt -68.38 -53.1 26.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 74.420000000000002 110.366 178.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mp -60.71 -39.39 88.38 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.336 -0.393 . . . . 74.430000000000007 111.592 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.59 HD13 HD11 ' A' ' 61' ' ' ILE . 4.0 mm? -61.66 -40.09 93.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.996 0.427 . . . . 62.420000000000002 110.787 178.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.664 ' HB2' ' HE1' ' A' ' 65' ' ' TRP . 28.8 t70 -66.7 -35.74 80.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.278 -0.419 . . . . 72.329999999999998 110.595 178.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -64.51 -42.55 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 75.140000000000001 111.255 -178.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.59 HD11 HD13 ' A' ' 58' ' ' LEU . 6.8 pt -77.76 -17.05 14.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.741 0.305 . . . . 75.349999999999994 111.682 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 117.4 29.75 2.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.08 -1.057 . . . . 50.200000000000003 113.949 172.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -84.57 106.9 16.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.532 -0.544 . . . . 72.120000000000005 109.532 175.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 12.9 p -75.14 133.89 30.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.626 -0.715 . . . . 61.450000000000003 110.892 -177.343 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.664 ' HE1' ' HB2' ' A' ' 59' ' ' ASP . 86.8 m95 -101.89 8.85 41.07 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.689 0.28 . . . . 72.299999999999997 111.445 -172.237 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.439 ' H ' HG22 ' A' ' 64' ' ' VAL . 41.0 m -57.98 111.33 1.14 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.061 -0.518 . . . . 63.32 111.582 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 62.0 mt -134.3 174.28 10.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.67 -0.695 . . . . 34.340000000000003 109.666 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 63.33 24.81 14.4 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 123.565 0.54 . . . . 73.019999999999996 110.829 174.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -59.6 113.66 2.34 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.479 -0.563 . . . . 74.140000000000001 109.479 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -53.24 104.81 0.1 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.495 -0.775 . . . . 62.329999999999998 112.105 -173.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 35.2 m80 -103.24 -82.89 0.49 Allowed 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.83 -0.804 . . . . 74.120000000000005 108.83 171.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -152.21 175.22 12.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.462 -0.79 . . . . 73.239999999999995 109.186 175.374 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -123.1 160.61 26.05 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.697 -0.853 . . . . 72.230000000000004 108.697 175.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 . . . . . 0 C--O 1.246 0.878 0 C-N-CA 120.669 -0.413 . . . . 64.519999999999996 110.459 178.521 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 120.652 0.263 . . . . 72.530000000000001 111.243 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -125.18 121.05 33.03 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.669 -0.493 . . . . 73.109999999999999 109.669 176.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -73.09 144.2 47.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.834 0.349 . . . . 64.209999999999994 110.797 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 5' ' ' LEU . 31.4 m-80 -88.75 -30.77 18.8 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.275 -0.639 . . . . 72.010000000000005 109.275 177.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.437 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 3.3 mm? 70.63 150.74 0.09 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.943 -1.026 . . . . 71.310000000000002 110.773 -176.009 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -89.08 99.59 12.55 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.96 0.409 . . . . 75.420000000000002 109.907 179.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.56 84.04 1.2 Allowed Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.906 -0.664 . . . . 73.129999999999995 111.624 -176.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -60.46 -47.01 88.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.826 0.345 . . . . 43.530000000000001 110.621 -177.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.669 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -76.82 -30.36 56.35 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.416 -0.356 . . . . 75.549999999999997 110.844 -176.571 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -38.01 85.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 72.030000000000001 109.705 175.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.437 ' HE2' ' HB2' ' A' ' 5' ' ' LEU . 25.1 ttmt -70.14 -49.42 50.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.493 -0.776 . . . . 55.020000000000003 110.097 174.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.462 ' HB2' ' HA ' ' A' ' 9' ' ' TRP . 74.1 m-20 -54.61 -46.4 73.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.19 -0.913 . . . . 75.25 111.511 -178.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.423 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 32.4 t80 -55.65 -48.0 75.71 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.923 -0.581 . . . . 61.450000000000003 112.039 -173.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 11' ' ' LYS . 17.1 pt-20 -68.78 -34.85 76.25 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.96 -0.296 . . . . 72.019999999999996 111.259 -175.381 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -76.03 -40.91 52.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.033 0.444 . . . . 75.310000000000002 110.121 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.571 HD21 ' CD2' ' A' ' 58' ' ' LEU . 38.2 tp -57.04 -54.17 49.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 55.119999999999997 111.723 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 13' ' ' TYR . 8.4 mtpm? -51.79 -52.47 48.76 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.426 0.631 . . . . 70.310000000000002 110.556 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.9 m -58.9 -44.62 91.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.506 -1.225 . . . . 62.219999999999999 111.597 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.685 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 7.8 t80 -67.41 -52.42 40.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 74.530000000000001 110.422 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.435 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 78.1 t -60.1 -33.91 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.426 . . . . 75.530000000000001 111.621 178.409 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 21' ' ' ARG . 1.6 tmt_? -61.41 -26.84 68.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.377 -0.374 . . . . 75.329999999999998 111.106 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -108.94 -52.8 2.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.458 -0.337 . . . . 73.310000000000002 111.379 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 88.4 m-85 -90.7 -15.61 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.749 0.278 . . . . 64.349999999999994 111.749 -174.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.515 ' O ' ' HA ' ' A' ' 63' ' ' PHE . 26.6 mmt180 75.06 -18.46 0.44 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.632 0.773 . . . . 74.420000000000002 112.861 -178.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.522 ' HG3' ' HD3' ' A' ' 27' ' ' PRO . 25.9 ptt180 177.16 174.0 0.45 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.858 -0.423 . . . . 74.400000000000006 109.858 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.685 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 7.7 p90 -138.8 85.6 16.5 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 71.439999999999998 111.363 177.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.522 ' HD3' ' HG3' ' A' ' 25' ' ' ARG . 63.3 Cg_endo -76.19 -15.22 18.33 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.273 1.982 . . . . 71.340000000000003 110.914 173.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.417 ' HB2' ' HE3' ' A' ' 28' ' ' LYS . 37.0 ttmt -145.6 81.31 1.61 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.874 -1.057 . . . . 74.439999999999998 108.649 179.252 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.682 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 32.1 t -95.36 -50.21 5.12 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.084 -0.507 . . . . 71.310000000000002 110.594 -174.469 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.69 -46.07 0.39 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.121 0.969 . . . . 63.219999999999999 113.604 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.02 162.24 13.32 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.959 0.725 . . . . 65.129999999999995 112.959 -171.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 69.69 -175.9 33.25 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 114.909 -1.041 . . . . 32.509999999999998 112.743 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -69.44 -27.2 65.05 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.112 -0.699 . . . . 72.530000000000001 109.112 176.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.2 mt -63.64 -43.88 95.5 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.441 -0.8 . . . . 71.329999999999998 110.934 177.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.604 ' HA2' ' HB3' ' A' ' 29' ' ' SER . . . -51.82 -42.5 53.24 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 120.838 -0.696 . . . . 31.41 112.743 176.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.94 -34.49 27.03 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.313 -0.946 . . . . 43.530000000000001 112.261 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.504 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 17.2 t90 -57.17 -49.26 76.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.983 -0.377 . . . . 75.120000000000005 109.983 177.191 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.664 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 42.3 t -58.34 -50.72 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.919 -0.582 . . . . 74.510000000000005 110.63 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -61.62 -37.51 84.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.929 -0.578 . . . . 74.530000000000001 112.257 -176.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 m -82.78 -36.28 25.79 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.902 0.382 . . . . 65.109999999999999 111.405 -177.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.799 ' HG3' HD21 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.58 -18.29 61.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 73.099999999999994 111.581 -176.447 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 38' ' ' CYS . 18.0 mmt180 -52.78 -47.63 67.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.354 0.597 . . . . 71.409999999999997 109.954 173.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 47' ' ' GLN . 1.2 tmmm? -70.29 -42.12 72.46 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.074 -0.967 . . . . 71.140000000000001 110.827 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.659 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.5 mmt -64.11 -35.85 82.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.233 0.54 . . . . 72.420000000000002 110.651 -177.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.595 ' CB ' HD12 ' A' ' 50' ' ' LEU . 2.2 tmm_? -69.42 -49.66 53.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.334 -0.848 . . . . 70.150000000000006 110.17 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.02 -31.58 68.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.157 -0.474 . . . . 63.509999999999998 110.646 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.524 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 20.0 tp60 -72.74 -22.12 60.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.525 . . . . 61.210000000000001 110.575 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.42 37.52 27.39 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.728 -0.749 . . . . 64.439999999999998 111.98 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.524 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 19.2 ptmt -121.06 -1.3 9.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.189 0.519 . . . . 74.319999999999993 110.917 177.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.799 HD21 ' HG3' ' A' ' 41' ' ' GLN . 7.0 mt -68.97 142.58 93.5 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.768 -0.651 . . . . 64.430000000000007 110.09 172.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -73.67 138.32 26.35 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.0 2.466 . . . . 74.319999999999993 111.54 174.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -72.37 -34.8 68.22 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.161 -0.927 . . . . 75.109999999999999 112.457 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.628 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 36.0 m-20 -54.76 -51.86 64.38 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.872 0.367 . . . . 73.349999999999994 110.546 -177.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.669 ' HG3' ' CZ2' ' A' ' 9' ' ' TRP . 2.8 ttp85 -55.58 -38.88 69.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 70.510000000000005 111.301 177.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -59.8 -43.76 94.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.051 0.453 . . . . 72.409999999999997 110.539 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.33 -33.32 63.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.9 -0.591 . . . . 74.549999999999997 110.654 -177.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.2 mt -60.96 -36.45 79.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 72.5 110.633 177.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.656 HD12 ' CZ2' ' A' ' 65' ' ' TRP . 23.9 mt -63.61 -37.9 89.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 75.120000000000005 110.241 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.27 -25.91 68.26 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.942 -0.572 . . . . 73.400000000000006 111.187 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -36.19 56.06 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.405 -0.362 . . . . 73.409999999999997 110.932 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.4 pt -81.53 -12.22 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.82 0.343 . . . . 64.219999999999999 111.189 177.213 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.85 18.97 10.02 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.585 -0.817 . . . . 64.230000000000004 113.073 176.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.549 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 42.6 t80 -76.63 107.17 8.73 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.001 -0.74 . . . . 74.120000000000005 109.001 176.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.73 HG22 ' H ' ' A' ' 66' ' ' SER . 13.2 p -78.3 130.96 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 CA-C-N 115.346 -0.843 . . . . 75.349999999999994 111.224 -175.36 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.656 ' CZ2' HD12 ' A' ' 58' ' ' LEU . 99.8 m95 -93.8 18.42 10.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.611 -0.722 . . . . 74.209999999999994 110.51 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.73 ' H ' HG22 ' A' ' 64' ' ' VAL . 8.4 t 64.1 -165.1 0.24 Allowed 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.206 -0.906 . . . . 63.109999999999999 110.79 -179.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.656 ' HG ' ' H ' ' A' ' 68' ' ' GLU . 21.8 tp 65.89 178.47 0.21 Allowed 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.667 0.604 . . . . 63.439999999999998 110.097 -177.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.656 ' H ' ' HG ' ' A' ' 67' ' ' LEU . 42.7 tt0 -83.12 78.62 9.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.365 0.602 . . . . 74.420000000000002 110.942 -178.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -98.97 90.0 4.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.677 -0.692 . . . . 72.430000000000007 109.572 172.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -75.53 101.64 4.95 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.211 -0.663 . . . . 74.019999999999996 109.211 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -80.8 106.8 13.09 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.847 -0.615 . . . . 63.100000000000001 110.582 -173.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -87.58 132.67 33.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.087 -0.506 . . . . 71.319999999999993 110.215 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.0 p80 -78.86 148.59 32.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.978 0.418 . . . . 54.329999999999998 110.345 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.6 p80 . . . . . 0 C--O 1.247 0.966 0 CA-C-N 115.921 -0.582 . . . . 73.430000000000007 109.512 179.31 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.528 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 8.3 t-105 . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 120.634 0.254 . . . . 75.43 110.538 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.425 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.7 tpt -56.64 -45.54 81.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.136 -0.483 . . . . 73.22 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmpt? -68.36 -45.21 73.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 73.34 110.798 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -69.62 -35.92 75.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.342 -0.39 . . . . 73.13 111.397 -177.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.44 ' CE1' ' HB3' ' A' ' 57' ' ' LEU . 44.4 t80 -59.29 -50.97 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.779 -0.191 . . . . 75.53 111.088 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.82 -25.05 64.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.817 0.342 . . . . 73.22 111.176 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.487 ' OE2' ' HG ' ' A' ' 34' ' ' LEU . 34.8 tt0 -72.18 -41.12 67.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 62.22 110.107 177.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.538 HD12 HD22 ' A' ' 34' ' ' LEU . 7.1 tt -79.94 -31.51 40.05 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.878 -0.786 . . . . 65.45 108.878 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.692 ' HA ' HD12 ' A' ' 61' ' ' ILE . 85.4 tttt -55.68 -49.78 72.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.194 . . . . 74.43 110.371 174.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 m -72.75 -31.08 64.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.44 -0.8 . . . . 72.22 110.793 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.631 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 29.3 t80 -70.81 -46.99 61.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 71.11 110.377 -178.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.914 HG22 ' H ' ' A' ' 25' ' ' ARG . 24.2 t -65.2 -34.27 69.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.358 -0.383 . . . . 65.11 111.688 177.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -58.5 -20.94 50.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.292 0.568 . . . . 72.11 109.983 175.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -100.48 -47.75 4.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.024 -0.535 . . . . 61.32 111.646 -176.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -111.49 -25.92 9.34 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.378 0.881 . . . . 74.33 113.378 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.872 ' HA ' HG13 ' A' ' 20' ' ' VAL . 3.0 mpt_? 60.21 92.03 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.908 -0.405 . . . . 70.32 109.908 -166.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.914 ' H ' HG22 ' A' ' 20' ' ' VAL . 33.3 ttt180 67.59 161.64 0.18 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.75 0.786 . . . . 65.44 111.548 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.631 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 5.7 p90 . . . . . 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 62.41 110.513 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.9 t30 . . . . . 0 N--CA 1.464 0.258 0 CA-C-O 120.607 0.242 . . . . 65.24 111.269 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.538 HD22 HD12 ' A' ' 16' ' ' LEU . 77.7 mt -66.96 -34.26 77.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.847 0.356 . . . . 73.53 110.141 178.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.29 -43.15 97.49 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 53.05 112.181 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.36 -39.15 57.77 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.839 -0.696 . . . . 63.12 111.417 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.492 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 6.3 t90 -60.15 -42.53 95.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.91 0.386 . . . . 73.53 110.444 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.5 t -66.14 -38.83 89.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 72.52 110.888 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.6 m80 -59.25 -47.86 83.79 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 73.14 110.64 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.49 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 9.2 m -67.22 -35.1 78.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.204 0.526 . . . . 72.12 110.571 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.492 ' HB2' ' O ' ' A' ' 37' ' ' TRP . 3.2 tp-100 -65.12 -28.37 69.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.567 -0.742 . . . . 74.31 111.675 -174.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -54.77 -46.5 74.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 75.31 110.939 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.558 ' HD3' ' H ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -74.04 -22.53 59.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.062 -0.517 . . . . 73.41 110.717 -176.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.491 ' CB ' ' HG ' ' A' ' 50' ' ' LEU . 25.7 mmt -67.09 -46.25 74.83 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.412 -0.588 . . . . 73.32 109.412 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.519 ' HB2' HD12 ' A' ' 50' ' ' LEU . 8.1 tmm_? -75.48 -35.68 60.8 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.272 -0.876 . . . . 74.51 109.819 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.512 ' HB3' ' HA ' ' A' ' 43' ' ' LYS . 1.7 tmtp? -61.0 -47.3 87.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.88 -0.6 . . . . 73.22 110.706 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -75.4 -31.86 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.142 -0.481 . . . . 74.31 110.873 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.36 21.65 37.31 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.825 -0.702 . . . . 52.54 111.85 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.436 ' HD3' ' SD ' ' A' ' 44' ' ' MET . 13.8 ptmt -95.96 -5.1 42.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.095 0.474 . . . . 72.22 109.763 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' ' 45' ' ' ARG . 1.3 mt -57.43 138.95 81.03 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.047 -0.979 . . . . 63.45 110.163 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 3.5 Cg_exo -82.46 128.09 5.32 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.115 2.543 . . . . 71.5 111.191 174.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -61.13 -28.54 69.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.817 -0.629 . . . . 53.34 111.806 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -66.87 -46.11 76.0 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.071 0.463 . . . . 60.13 109.973 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.528 ' HG2' ' CH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -62.44 -41.57 98.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.005 -0.739 . . . . 73.11 109.005 176.267 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -62.0 -44.62 96.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.103 -0.953 . . . . 72.24 110.646 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.64 -41.99 74.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 52.21 111.724 -177.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.44 ' HB3' ' CE1' ' A' ' 13' ' ' TYR . 5.9 mp -57.87 -43.07 85.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.709 0.262 . . . . 55.43 111.709 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.513 HD22 ' NH2' ' A' ' 54' ' ' ARG . 9.3 mp -71.6 -33.38 68.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 65.15 111.095 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.92 -38.37 90.73 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.225 0.535 . . . . 51.53 110.014 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -69.86 -29.99 67.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.173 -0.921 . . . . 75.54 112.128 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.692 HD12 ' HA ' ' A' ' 17' ' ' LYS . 26.2 pt -84.61 -8.47 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.592 -0.443 . . . . 74.25 110.917 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.06 18.44 9.89 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.701 -0.761 . . . . 65.14 113.467 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -79.44 104.66 10.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.526 0.679 . . . . 70.12 109.732 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.447 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 13.0 p . . . . . 0 N--CA 1.442 -0.849 0 CA-C-N 114.945 -1.025 . . . . 74.14 110.881 -177.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 . . . . . 0 N--CA 1.457 -0.083 0 N-CA-C 109.64 -0.504 . . . . 74.44 109.64 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.502 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 8.0 mmt -61.16 -40.34 93.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.067 0.46 . . . . 72.53 109.783 176.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -49.81 75.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.35 -0.841 . . . . 74.24 110.067 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.411 HD21 ' HB3' ' A' ' 33' ' ' ASN . 10.4 m-80 -57.04 -44.23 82.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.097 -0.501 . . . . 52.12 110.835 177.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.635 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 56.3 t80 -61.36 -52.25 65.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.849 -0.614 . . . . 74.03 110.578 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.824 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 50.7 mm-40 -61.62 -37.54 84.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.763 0.316 . . . . 62.42 110.797 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -65.27 -42.34 93.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.272 -0.422 . . . . 64.24 110.105 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 tp -68.05 -37.31 81.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.913 -0.585 . . . . 62.23 110.82 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.824 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 59.2 mtpt -55.42 -49.87 71.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.486 0.66 . . . . 73.03 109.408 172.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 21.3 t -59.72 -40.84 89.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.34 -1.3 . . . . 74.53 110.739 176.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.27 -37.72 88.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 120.904 0.383 . . . . 73.54 110.728 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.612 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 21.3 t -71.76 -40.64 69.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.785 0.661 . . . . 71.53 112.785 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -65.29 -17.0 64.15 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 119.826 -0.75 . . . . 73.13 110.439 178.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.442 ' HG3' ' HD3' ' A' ' 21' ' ' ARG . 85.6 mttt -97.76 -64.48 1.04 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.957 -0.565 . . . . 71.5 111.654 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -110.62 -5.9 14.96 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 73.33 111.938 -172.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.612 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 4.3 mpt_? 63.67 12.8 6.85 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.893 0.477 . . . . 53.31 110.759 -177.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 39.6 ttt180 -170.38 168.78 7.82 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.744 -0.836 . . . . 73.15 108.744 -171.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.643 ' HE2' ' HB2' ' A' ' 38' ' ' CYS . 8.3 p90 . . . . . 0 C--N 1.319 -0.74 0 CA-C-O 121.505 0.669 . . . . 71.22 109.89 174.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.411 ' HB3' HD21 ' A' ' 12' ' ' ASN . 77.3 m-20 . . . . . 0 CA--C 1.522 -0.098 0 CA-C-O 120.976 0.417 . . . . 73.21 110.524 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.628 ' HA ' ' HB2' ' A' ' 37' ' ' TRP . 94.1 mt -71.95 -27.35 62.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.054 -0.521 . . . . 71.24 110.408 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.6 -43.72 98.9 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 110.604 -0.999 . . . . 74.35 110.604 173.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.23 -28.91 61.14 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.025 -0.607 . . . . 63.1 111.606 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.628 ' HB2' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.94 -50.52 70.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.371 0.605 . . . . 64.22 109.52 174.07 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.643 ' HB2' ' HE2' ' A' ' 26' ' ' PHE . 48.6 t -64.73 -40.48 95.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.177 -0.92 . . . . 73.24 111.049 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 44.7 m170 -72.02 -54.72 9.04 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.943 0.349 . . . . 74.23 111.943 -175.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.1 m -63.99 -40.43 96.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.079 0.466 . . . . 75.02 111.148 -174.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.718 ' HG2' HD21 ' A' ' 50' ' ' LEU . 9.9 mt-30 -84.13 -11.24 56.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.105 -0.498 . . . . 43.54 111.686 -177.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.607 ' HB2' ' O ' ' A' ' 38' ' ' CYS . 6.1 tpt180 -62.45 -36.25 81.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.932 0.873 . . . . 74.32 109.291 174.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 71.6 tttt -73.63 -54.36 8.33 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.405 -1.27 . . . . 75.25 111.134 178.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.484 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.4 mmt -57.62 -38.42 74.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.996 -0.547 . . . . 71.23 112.021 -178.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.456 ' HB3' HD12 ' A' ' 50' ' ' LEU . 9.5 ptm180 -65.24 -32.39 74.03 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.995 0.426 . . . . 75.33 110.899 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.16 -43.8 50.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.42 0.629 . . . . 64.25 109.561 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.506 ' NE2' ' HG3' ' A' ' 49' ' ' LYS . 27.8 mt-30 -72.58 -30.13 64.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.09 -0.959 . . . . 72.22 111.831 -177.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.87 30.41 17.88 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.523 -1.031 . . . . 74.34 110.523 -171.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.886 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -102.35 -8.44 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 115.3 -0.45 . . . . 74.34 110.257 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 41' ' ' GLN . 2.9 mt -63.33 139.02 97.51 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.603 -0.726 . . . . 74.51 109.51 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.715 ' HD2' HD23 ' A' ' 50' ' ' LEU . 56.5 Cg_endo -75.71 145.19 28.82 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.105 1.87 . . . . 73.54 112.337 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.1 -30.4 70.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.347 -0.842 . . . . 52.54 110.264 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.694 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.7 m-20 -59.73 -51.01 71.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.914 -0.584 . . . . 71.04 110.828 176.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.469 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 2.3 tmt_? -57.31 -38.23 73.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.096 0.474 . . . . 64.31 110.018 -179.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttt180 -64.6 -49.58 70.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.797 -0.638 . . . . 71.44 110.475 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 tt -64.87 -40.02 94.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.352 -0.84 . . . . 74.41 110.13 -176.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.694 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.4 mt -55.12 -39.94 69.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 73.31 111.042 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 87.3 mt -61.85 -45.48 93.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.036 -0.529 . . . . 71.23 110.665 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -65.36 -33.42 75.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.972 0.415 . . . . 63.31 110.879 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.71 -36.14 75.65 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.929 -0.578 . . . . 74.34 111.16 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.696 HG21 ' HG2' ' A' ' 17' ' ' LYS . 19.5 pt -85.68 -26.57 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.594 -0.275 . . . . 62.44 111.524 176.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 109.97 33.85 2.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.548 -0.834 . . . . 60.5 112.797 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.607 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 77.8 t80 -72.31 135.21 45.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.877 0.37 . . . . 64.51 110.328 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 N--CA 1.445 -0.718 0 CA-C-O 121.55 0.69 . . . . 71.12 110.554 -179.046 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.474 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.145 0 N-CA-C 109.023 -0.732 . . . . 65.22 109.023 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 47.9 ttm -55.32 -33.81 63.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 52.42 110.871 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.36 -53.98 20.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.56 -0.745 . . . . 72.11 110.471 -177.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.457 ' ND2' ' HA ' ' A' ' 9' ' ' TRP . 8.3 p30 -77.11 -20.06 56.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.75 0.309 . . . . 75.24 111.077 -176.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 17' ' ' LYS . 74.8 t80 -51.38 -43.78 61.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 74.22 110.137 173.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -62.91 -36.4 83.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.891 -0.595 . . . . 74.32 111.304 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.3 -44.1 92.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 73.03 111.237 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 16' ' ' LEU . 3.4 tt -79.14 -32.58 44.43 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.591 -0.892 . . . . 72.14 108.591 -176.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 13' ' ' TYR . 84.5 tttt -51.38 -51.91 50.49 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.729 -1.123 . . . . 73.3 110.511 174.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 25.6 t -76.58 -34.62 58.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.495 -0.775 . . . . 74.54 110.685 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.55 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 3.1 t80 -66.0 -45.35 81.89 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.869 0.366 . . . . 73.32 110.861 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.551 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 7.7 p -65.75 -34.4 70.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.373 -0.376 . . . . 73.33 111.588 -176.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.457 ' C ' ' HD2' ' A' ' 21' ' ' ARG . 5.6 ppt_? -79.43 -16.39 56.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.352 0.596 . . . . 73.12 110.325 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.8 tptm -89.31 -53.72 4.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.694 -0.685 . . . . 75.22 111.137 -174.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -115.57 -10.36 11.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.8 -0.182 . . . . 75.22 111.364 -178.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.551 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 64.16 93.45 0.06 Allowed 'General case' 0 CA--C 1.518 -0.286 0 O-C-N 123.667 0.604 . . . . 75.34 110.126 -170.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.665 ' HD3' ' O ' ' A' ' 64' ' ' VAL . 57.0 mtm180 65.92 -174.69 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 114.569 -1.196 . . . . 74.3 110.551 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.55 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 2.9 p90 . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.785 -0.643 . . . . 74.24 109.819 171.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 37' ' ' TRP . 6.9 p30 . . . . . 0 CA--C 1.53 0.174 0 N-CA-C 111.461 0.171 . . . . 61.31 111.461 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.43 -28.31 59.31 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.869 0.366 . . . . 53.32 110.807 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.16 -45.59 96.24 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.689 -0.767 . . . . 74.24 111.53 178.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.03 -29.31 59.03 Favored Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 111.143 -0.783 . . . . 65.31 111.143 176.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.466 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 2.7 t90 -58.16 -55.79 30.42 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.085 0.554 . . . . 73.22 110.508 178.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.32 -46.76 87.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 73.04 110.787 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.444 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.3 m80 -57.43 -46.21 83.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.122 -0.49 . . . . 75.5 112.013 -178.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.3 t -70.65 -35.08 72.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.018 0.437 . . . . 62.52 110.848 -175.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.598 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 3.0 mt-30 -86.42 -21.39 27.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.23 0.826 . . . . 70.22 113.23 -172.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -69.17 -22.75 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.095 -0.642 . . . . 75.12 109.494 174.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 2.8 tmmm? -73.45 -30.41 63.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.359 -0.837 . . . . 70.35 109.952 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.598 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 13.4 mmt -67.62 -33.83 75.77 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.744 0.307 . . . . 74.3 110.39 174.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.739 ' HB2' HD12 ' A' ' 50' ' ' LEU . 17.4 tpt180 -72.98 -39.06 66.41 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.519 -0.472 . . . . 75.1 110.389 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -56.93 -44.76 82.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.372 0.606 . . . . 72.21 109.602 173.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.496 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 47.7 mt-30 -64.83 -29.58 70.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.191 -0.913 . . . . 71.4 110.996 174.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.99 28.65 44.86 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.969 -0.634 . . . . 75.13 111.582 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.496 ' HG2' ' HB2' ' A' ' 47' ' ' GLN . 18.3 ptmt -113.16 0.42 14.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 73.24 111.025 -176.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.739 HD12 ' HB2' ' A' ' 45' ' ' ARG . 1.8 mt -58.81 139.94 86.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.81 -0.632 . . . . 75.41 110.207 179.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 4.3 Cg_exo -82.23 158.63 17.56 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 122.672 2.248 . . . . 73.53 111.486 173.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -71.08 -31.8 68.28 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.07 -0.968 . . . . 73.51 110.643 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.6 -51.24 50.32 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.917 -0.583 . . . . 74.14 112.231 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.582 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 47.5 ttt-85 -60.92 -50.52 73.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.047 0.451 . . . . 72.42 110.451 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.408 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -64.89 -26.83 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.764 -0.653 . . . . 61.42 110.964 -178.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -77.11 -51.73 10.52 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.212 -0.449 . . . . 74.53 110.726 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.2 mp -58.99 -43.23 91.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.447 -0.342 . . . . 53.35 111.043 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.631 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 71.2 mt -62.24 -40.77 97.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 75.34 110.31 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.408 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 15.6 t70 -57.68 -41.18 81.09 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.861 -0.609 . . . . 45.22 111.105 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.439 ' HD2' ' N ' ' A' ' 60' ' ' LYS . 1.6 mptp? -77.31 -28.93 53.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.756 -0.656 . . . . 74.32 112.589 -173.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 16.1 pt -82.85 -14.34 11.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.269 -0.572 . . . . 71.14 110.89 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 112.16 23.52 5.48 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.37 -0.919 . . . . 33.23 113.532 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.631 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 32.6 t80 -88.58 103.8 16.24 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.344 0.592 . . . . 53.51 109.794 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.665 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 14.4 p . . . . . 0 N--CA 1.443 -0.791 0 CA-C-N 115.205 -0.907 . . . . 72.03 110.775 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.468 ' HZ2' HD13 ' A' ' 57' ' ' LEU . 6.2 t-105 . . . . . 0 C--O 1.228 -0.029 0 CA-C-O 120.908 0.385 . . . . 72.33 110.36 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 78.1 mmm -61.6 -29.88 70.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 74.05 110.42 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -78.26 -49.6 13.41 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.522 -0.763 . . . . 71.03 109.788 176.587 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.442 HD21 ' HB3' ' A' ' 33' ' ' ASN . 2.0 t-20 -52.74 -35.67 56.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.194 0.998 . . . . 74.2 111.164 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -52.87 -39.41 62.6 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.979 -1.009 . . . . 73.51 110.833 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -63.44 -43.24 97.97 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.139 0.274 . . . . 75.1 111.521 -177.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.406 ' HB3' HD11 ' A' ' 34' ' ' LEU . 3.3 mp0 -63.52 -40.45 97.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.002 0.43 . . . . 73.52 110.771 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.9 tp -78.65 -45.36 21.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.439 0.638 . . . . 74.4 109.321 -173.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -51.05 -51.02 57.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.442 -1.254 . . . . 63.52 111.353 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.0 m -70.41 -38.28 74.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.251 -0.886 . . . . 71.13 111.029 -176.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.413 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 17.2 t80 -76.36 -44.98 34.05 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.446 -0.502 . . . . 72.11 111.092 -173.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.682 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 54.5 t -61.4 -33.91 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.144 -0.48 . . . . 73.11 110.993 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.464 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -58.26 -29.26 65.65 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.112 0.482 . . . . 55.32 110.767 176.013 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -91.26 -61.58 1.63 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.225 -0.443 . . . . 62.43 111.703 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -101.59 -6.7 23.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.35 0.5 . . . . 64.23 112.35 -174.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.682 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 28.4 mmt180 68.43 -0.59 2.17 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.173 0.589 . . . . 71.11 111.684 -178.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 80.9 mtt180 -168.71 172.01 8.25 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.326 1.05 . . . . 72.04 108.722 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.485 ' HZ ' ' HB2' ' A' ' 38' ' ' CYS . 10.2 p90 . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 121.345 0.593 . . . . 71.45 110.332 172.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.442 ' HB3' HD21 ' A' ' 12' ' ' ASN . 15.0 m120 . . . . . 0 N--CA 1.461 0.098 0 CA-C-O 120.729 0.3 . . . . 72.45 111.792 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.406 HD11 ' HB3' ' A' ' 15' ' ' GLU . 83.0 mt -71.9 -38.76 69.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.415 -0.357 . . . . 74.23 111.756 -173.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.95 -43.74 96.6 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.923 -0.656 . . . . 43.0 111.889 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.19 -34.77 54.49 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.382 -0.687 . . . . 64.2 111.382 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.506 ' HH2' HD21 ' A' ' 58' ' ' LEU . 9.0 t90 -54.34 -52.22 62.26 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.31 0.576 . . . . 72.43 109.831 174.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.485 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.1 t -62.49 -46.33 88.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.937 -1.029 . . . . 55.53 111.131 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -56.77 -45.56 82.04 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.832 0.308 . . . . 73.23 111.832 -177.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.456 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 91.6 m -65.07 -48.17 74.73 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.314 -0.403 . . . . 64.01 111.691 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -84.7 -24.41 28.95 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.217 0.821 . . . . 71.44 113.217 -170.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' C ' ' HD2' ' A' ' 42' ' ' ARG . 1.4 tmm_? -62.88 -33.34 75.09 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.731 -0.84 . . . . 73.04 108.731 173.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 40' ' ' THR . 62.3 tttt -61.88 -50.52 71.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.248 -0.887 . . . . 74.53 110.575 175.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.664 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.6 mmt -61.39 -34.0 74.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 75.32 110.848 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.02 -48.11 81.75 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.458 -0.571 . . . . 61.31 109.458 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.9 tttp -66.65 -49.32 66.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.287 -0.869 . . . . 74.13 111.054 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.437 ' NE2' ' HD3' ' A' ' 49' ' ' LYS . 26.5 mt-30 -60.79 -32.08 71.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.943 -0.571 . . . . 73.35 111.757 178.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.32 41.01 5.91 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.581 -0.819 . . . . 60.35 111.95 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.437 ' HD3' ' NE2' ' A' ' 47' ' ' GLN . 16.2 ptmt -133.31 11.47 4.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.014 0.435 . . . . 75.01 111.459 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.664 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 4.1 mt -64.79 141.24 98.28 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-N 115.88 -0.6 . . . . 63.43 109.808 175.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.69 134.84 31.42 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.72 2.28 . . . . 74.14 111.755 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -60.19 -39.48 86.7 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.378 -0.828 . . . . 72.32 109.942 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.637 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.8 m-20 -56.61 -43.72 80.45 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.729 -0.669 . . . . 65.43 110.44 176.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -62.5 -49.47 75.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.563 -0.744 . . . . 42.34 110.265 -178.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -51.73 -44.37 63.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.403 -0.817 . . . . 74.33 110.309 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.604 ' HA ' ' OD2' ' A' ' 59' ' ' ASP . 7.0 mp -64.7 -41.71 95.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 72.11 111.481 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.1 mt -53.19 -39.38 63.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.937 0.399 . . . . 65.54 110.648 178.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 4.3 mm? -68.48 -49.51 59.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.68 -0.691 . . . . 75.32 111.411 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.604 ' OD2' ' HA ' ' A' ' 56' ' ' LEU . 1.9 p30 -73.27 -20.56 60.8 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.154 -0.619 . . . . 73.11 111.03 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -65.86 -41.4 91.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.784 0.326 . . . . 74.45 111.407 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -84.61 -2.74 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 74.23 110.871 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.521 ' O ' ' HD2' ' A' ' 24' ' ' ARG . . . 97.23 22.89 15.79 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 120.76 -0.734 . . . . 34.21 113.609 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.593 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 72.1 t80 -75.05 133.31 41.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.473 0.654 . . . . 63.01 110.164 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 73.6 t . . . . . 0 C--N 1.316 -0.869 0 CA-C-N 115.058 -0.974 . . . . 72.42 110.715 -177.873 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.733 ' HH2' HH21 ' A' ' 54' ' ' ARG . 5.8 t-105 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.847 0.356 . . . . 72.33 110.429 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.503 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.1 tpt -56.88 -37.57 71.54 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.229 0.538 . . . . 61.32 110.29 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.444 ' C ' ' HD2' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.63 -46.91 51.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.64 -0.709 . . . . 72.52 110.594 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -56.82 -35.48 68.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.961 0.41 . . . . 65.24 110.767 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -59.94 -50.71 72.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.002 -0.544 . . . . 72.32 109.896 176.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 6.4 mm-40 -63.87 -39.04 93.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.083 -0.508 . . . . 73.33 110.717 176.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -61.82 -37.05 82.96 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.611 . . . . 74.14 110.282 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.764 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.0 tt -76.65 -43.21 39.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 65.35 111.016 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 58.2 mtpt -55.99 -57.02 13.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.329 0.585 . . . . 72.43 110.552 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.522 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 36.9 p -57.99 -30.2 65.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.853 -1.067 . . . . 74.25 111.322 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 34.8 t80 -70.62 -49.63 45.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.346 . . . . 72.51 110.305 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.2 t -59.63 -37.93 73.11 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 N-CA-C 111.777 0.288 . . . . 74.23 111.777 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.407 ' HG2' ' HA ' ' A' ' 18' ' ' SER . 19.7 ptt180 -74.71 -18.88 60.44 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.374 -0.53 . . . . 65.43 110.586 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 18' ' ' SER . 53.5 tttm -94.87 -46.38 6.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 64.25 111.335 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -118.31 -19.69 8.83 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.148 -0.221 . . . . 73.25 111.33 -176.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.626 HH12 ' HA3' ' A' ' 62' ' ' GLY . 11.3 mmm180 65.85 98.5 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 O-C-N 123.778 0.674 . . . . 73.04 111.563 -178.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.414 ' HG3' HG12 ' A' ' 64' ' ' VAL . 0.6 OUTLIER 71.29 163.4 0.26 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.936 -1.029 . . . . 75.25 110.962 179.074 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.572 ' HE2' ' HB3' ' A' ' 38' ' ' CYS . 8.4 p90 . . . . . 0 C--N 1.32 -0.687 0 CA-C-O 121.518 0.675 . . . . 72.21 110.81 175.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 . . . . . 0 CA--C 1.52 -0.189 0 CA-C-O 121.296 0.57 . . . . 72.23 109.717 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.764 HD11 ' HA ' ' A' ' 16' ' ' LEU . 57.2 mt -64.13 -33.68 76.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.213 -0.903 . . . . 72.43 111.155 -178.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -51.65 -43.22 53.29 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.934 -0.651 . . . . 72.33 111.985 172.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.04 -31.45 34.94 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.849 -0.691 . . . . 75.32 111.697 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.411 ' HB2' ' HA ' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -56.87 -50.54 72.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.901 0.382 . . . . 64.15 110.719 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.572 ' HB3' ' HE2' ' A' ' 26' ' ' PHE . 30.0 p -65.05 -30.34 71.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 72.52 111.118 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -63.61 -47.25 82.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.788 0.328 . . . . 73.03 111.08 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.447 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 23.5 m -77.62 -20.86 53.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.205 0.526 . . . . 52.32 110.945 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.524 ' HG3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -77.64 -25.82 50.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.553 -0.294 . . . . 70.24 110.972 179.667 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 12.3 mmt180 -54.1 -47.1 72.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.226 0.536 . . . . 71.21 109.599 172.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 40' ' ' THR . 28.1 tttp -51.54 -62.56 1.55 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.624 -1.171 . . . . 63.31 111.181 175.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.431 ' HE2' HG22 ' A' ' 40' ' ' THR . 11.8 mmt -55.81 -46.22 78.11 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.058 -0.519 . . . . 73.21 112.229 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.543 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -65.13 -39.33 92.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.342 0.497 . . . . 74.12 112.342 -170.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.445 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 62.9 pttt -80.21 -19.19 47.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 75.31 110.4 -179.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -89.77 -14.86 33.64 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.445 -0.798 . . . . 75.33 110.876 178.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.92 27.49 68.71 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.833 -0.622 . . . . 42.01 112.297 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -100.53 -12.8 18.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.76 0.314 . . . . 73.41 110.748 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 1.021 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.5 OUTLIER -60.03 139.12 91.0 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.86 -0.609 . . . . 70.23 109.661 177.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 1.021 ' HD2' HD23 ' A' ' 50' ' ' LEU . 39.9 Cg_endo -73.28 127.92 12.39 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.303 2.002 . . . . 74.31 112.671 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.413 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 32.4 t-20 -59.39 -37.39 77.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.001 -0.999 . . . . 71.44 109.876 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -56.1 -48.58 75.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.569 -0.741 . . . . 50.42 111.306 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.733 HH21 ' HH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -71.14 -26.24 62.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.266 -0.424 . . . . 73.22 110.118 -175.187 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.413 ' HB3' ' O ' ' A' ' 52' ' ' ASN . 25.4 ttm-85 -61.84 -39.97 93.67 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.155 0.502 . . . . 73.42 109.792 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 mp -70.2 -32.14 69.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.595 -0.729 . . . . 63.03 110.76 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.72 -39.4 94.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.151 0.501 . . . . 75.44 109.8 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.745 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 82.3 mt -71.04 -33.43 70.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.842 -0.617 . . . . 44.53 110.17 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.49 -32.65 74.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 74.43 110.887 177.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -62.0 -40.44 95.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 54.13 111.608 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 11.2 pt -87.99 -12.38 10.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.855 0.359 . . . . 73.32 111.362 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.626 ' HA3' HH12 ' A' ' 24' ' ' ARG . . . 102.79 25.86 7.41 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.69 -0.767 . . . . 74.1 113.623 174.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.745 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 56.2 t80 -76.33 104.96 7.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.484 -0.561 . . . . 74.2 109.484 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.414 HG12 ' HG3' ' A' ' 25' ' ' ARG . 6.6 p . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 74.05 111.133 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 108.823 -0.806 . . . . 73.42 108.823 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.5 ttm -58.09 -40.87 82.19 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.219 -0.446 . . . . 62.34 110.017 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -58.05 -55.84 29.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.391 -0.822 . . . . 61.13 110.098 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.99 -39.42 81.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.449 -0.796 . . . . 62.31 111.171 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -59.4 -47.96 83.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 75.31 110.824 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.31 -40.91 96.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.849 0.357 . . . . 61.22 111.119 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.691 ' HB3' HD21 ' A' ' 34' ' ' LEU . 16.5 mm-40 -62.67 -32.57 73.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.22 -0.446 . . . . 63.44 110.969 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.844 HD13 HD11 ' A' ' 58' ' ' LEU . 1.2 tt -84.79 -34.45 22.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.822 -0.807 . . . . 71.32 108.822 -178.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -55.38 -37.12 67.14 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.051 -0.977 . . . . 70.43 109.491 172.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -82.55 -27.65 31.49 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 73.13 110.951 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -75.27 -36.17 61.26 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.837 0.351 . . . . 75.5 110.843 -177.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.483 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 62.9 t -57.96 -38.02 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 73.21 110.276 173.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.532 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.5 tmt_? -76.03 -24.86 55.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.233 0.539 . . . . 74.21 109.944 176.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.436 ' HG3' ' CD2' ' A' ' 23' ' ' TYR . 24.5 tptm -71.66 -60.54 2.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.656 . . . . 75.5 111.482 -176.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.436 ' CD2' ' HG3' ' A' ' 22' ' ' LYS . 58.2 m-85 -126.15 3.96 7.15 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 63.22 112.196 -177.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.483 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 26.7 mmt-85 61.39 93.95 0.04 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.855 0.36 . . . . 74.21 110.802 -173.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.931 ' HG2' ' H ' ' A' ' 26' ' ' PHE . 40.2 ttt180 58.73 -169.57 0.13 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.618 -0.719 . . . . 74.35 109.927 -174.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.931 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.442 -0.843 0 CA-C-O 120.746 0.307 . . . . 71.33 110.253 170.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.835 0.35 . . . . 74.14 111.233 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.691 HD21 ' HB3' ' A' ' 15' ' ' GLU . 2.7 mm? -64.25 -28.55 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 74.45 111.062 -176.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -55.87 -44.77 87.36 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 74.42 112.062 174.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -83.08 -28.0 38.76 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.682 -0.771 . . . . 65.5 112.177 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.438 ' CH2' ' HG2' ' A' ' 41' ' ' GLN . 16.5 t90 -57.87 -50.55 72.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.707 -0.246 . . . . 72.43 111.02 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 26.8 p -59.85 -40.97 90.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.228 -0.442 . . . . 61.41 110.756 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -59.02 -46.1 89.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 73.53 110.73 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -76.16 -40.17 53.23 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.771 -0.65 . . . . 73.21 111.259 -175.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.438 ' HG2' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -78.7 -22.56 46.5 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.882 0.327 . . . . 53.24 111.882 -175.156 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.426 ' HD3' ' C ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -65.64 -33.22 75.39 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.702 -0.481 . . . . 73.0 109.702 176.379 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -58.42 -52.49 65.4 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.04 -0.527 . . . . 72.43 109.971 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.735 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 9.6 mmt -58.56 -33.35 69.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.335 -0.848 . . . . 74.04 110.657 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.95 -39.94 75.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.689 -0.687 . . . . 61.13 110.197 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -72.24 -48.5 42.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.876 -0.602 . . . . 55.12 110.698 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -63.56 -22.22 66.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.658 -0.701 . . . . 73.1 111.747 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 76.25 29.92 57.75 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.682 -0.771 . . . . 64.24 111.479 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -113.75 3.15 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.8 0.333 . . . . 63.32 110.45 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.735 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 2.6 mt -59.65 138.26 89.78 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.689 -0.687 . . . . 63.41 109.376 175.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.505 ' HG2' ' HB2' ' A' ' 54' ' ' ARG . 81.5 Cg_endo -84.62 149.45 11.35 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.218 1.945 . . . . 64.44 112.333 176.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -70.98 -27.44 63.71 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.15 -0.932 . . . . 75.43 109.976 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.55 -51.7 68.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 40.3 110.433 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.505 ' HB2' ' HG2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -63.87 -38.54 91.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 65.01 110.309 179.513 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -61.67 -45.94 91.87 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.038 -0.528 . . . . 61.1 110.563 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.3 tp -68.71 -42.27 77.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.387 -0.37 . . . . 65.44 111.55 -177.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.36 -39.46 79.61 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.737 0.303 . . . . 72.44 110.86 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.844 HD11 HD13 ' A' ' 16' ' ' LEU . 4.3 mm? -71.14 -43.31 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.24 0.543 . . . . 74.45 110.765 177.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.92 -28.55 69.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 64.34 110.231 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -74.61 -30.13 61.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 53.13 112.373 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.771 HD11 HD13 ' A' ' 58' ' ' LEU . 27.2 pt -87.72 1.47 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 120.519 -0.472 . . . . 61.21 111.101 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.88 16.31 31.19 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.449 -0.881 . . . . 73.32 113.021 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.55 105.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.062 0.458 . . . . 72.25 109.799 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.52 HG12 ' HB2' ' A' ' 25' ' ' ARG . 7.4 p . . . . . 0 N--CA 1.446 -0.645 0 CA-C-N 115.419 -0.81 . . . . 54.24 110.413 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.431 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 19.1 t-105 . . . . . 0 C--O 1.225 -0.209 0 N-CA-C 109.88 -0.415 . . . . 74.41 109.88 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.4 ttm -61.6 -37.73 84.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.146 -0.479 . . . . 72.24 110.482 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -56.93 -51.55 68.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.37 -0.832 . . . . 71.12 111.532 -178.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.422 HD21 ' HA ' ' A' ' 9' ' ' TRP . 11.1 p30 -78.18 -27.22 47.93 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.774 -0.37 . . . . 70.42 110.792 178.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -58.58 -46.05 87.78 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.492 -0.322 . . . . 74.33 111.351 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -65.16 -35.18 80.28 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 45.32 111.233 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.73 -33.66 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.278 0.561 . . . . 72.33 109.932 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 58' ' ' LEU . 47.0 tp -80.89 -39.93 25.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.347 -0.842 . . . . 72.4 109.537 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -55.6 -43.61 76.2 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.719 -1.128 . . . . 74.22 110.19 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.4 m -72.04 -34.93 69.17 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.492 -0.776 . . . . 72.04 110.425 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.658 ' HA ' ' HD2' ' A' ' 22' ' ' LYS . 32.0 t80 -71.82 -41.34 68.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 72.52 110.964 -175.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.68 -39.29 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.446 -0.343 . . . . 72.3 110.137 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -24.69 67.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.417 0.627 . . . . 73.4 109.847 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.658 ' HD2' ' HA ' ' A' ' 19' ' ' PHE . 42.0 mttm -77.53 -68.97 0.57 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.561 -0.745 . . . . 75.53 111.599 -178.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 45.8 m-85 -120.86 -15.24 8.37 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.027 -0.269 . . . . 75.53 111.518 -171.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 23' ' ' TYR . 1.1 mpp_? 70.72 111.53 0.06 Allowed 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 123.947 0.78 . . . . 73.43 110.789 -171.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.514 ' HG2' ' H ' ' A' ' 26' ' ' PHE . 22.0 ttt180 71.55 -178.25 0.21 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.724 -1.126 . . . . 75.43 110.23 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.514 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 3.6 m-85 . . . . . 0 C--N 1.33 -0.24 0 N-CA-C 111.541 0.2 . . . . 64.11 111.541 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 . . . . . 0 CA--C 1.519 -0.24 0 N-CA-C 108.904 -0.776 . . . . 65.34 108.904 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.548 HD21 ' HB2' ' A' ' 16' ' ' LEU . 88.9 mt -66.06 -30.23 70.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.952 -1.022 . . . . 64.0 111.248 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -53.73 -40.93 64.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.058 -0.591 . . . . 64.51 112.151 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.47 -32.33 31.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.778 -0.725 . . . . 61.44 111.626 176.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.667 ' CZ2' ' HD3' ' A' ' 54' ' ' ARG . 26.2 t90 -54.15 -55.27 29.36 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.178 0.591 . . . . 71.31 111.126 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 7.1 p -67.12 -30.79 70.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.788 -0.642 . . . . 55.15 111.624 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -67.35 -36.47 81.47 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.763 0.282 . . . . 64.52 111.763 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.0 m -72.08 -45.08 62.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.156 0.503 . . . . 52.44 110.885 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.46 ' HG2' HD21 ' A' ' 50' ' ' LEU . 19.3 mt-30 -80.68 -10.46 59.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.119 -0.491 . . . . 74.21 111.458 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 42' ' ' ARG . 4.8 tpt180 -56.27 -28.89 60.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.597 0.713 . . . . 55.22 109.429 171.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -88.08 -58.24 2.64 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.723 -1.126 . . . . 61.42 111.076 177.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.4 mmt -56.7 -33.02 66.04 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.747 -0.661 . . . . 75.33 112.105 -172.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.654 ' HA ' HD12 ' A' ' 50' ' ' LEU . 4.0 tmm_? -58.1 -50.53 73.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.324 -0.398 . . . . 75.11 111.115 -175.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -81.73 -16.59 50.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.011 0.434 . . . . 72.53 111.158 -174.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -99.65 3.64 45.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.141 -0.481 . . . . 74.23 111.483 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 64.0 27.17 70.94 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 120.779 -0.724 . . . . 75.35 112.315 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.747 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.3 mmpt? -99.34 -6.52 27.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.158 0.504 . . . . 73.2 109.85 -178.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.8 HD23 ' HD2' ' A' ' 51' ' ' PRO . 2.2 mt -62.32 141.02 96.4 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 115.161 -0.927 . . . . 72.51 110.258 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.8 ' HD2' HD23 ' A' ' 50' ' ' LEU . 64.5 Cg_endo -76.75 154.89 34.73 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.801 2.334 . . . . 62.12 112.997 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -71.76 -54.24 10.85 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.047 -0.979 . . . . 63.43 112.012 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.11 -34.88 64.06 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.023 0.44 . . . . 53.3 110.874 -175.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.667 ' HD3' ' CZ2' ' A' ' 37' ' ' TRP . 3.0 tmm_? -56.37 -42.85 78.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.403 -0.817 . . . . 73.51 110.134 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -67.0 -47.25 72.04 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 120.579 -0.448 . . . . 73.34 110.694 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.66 -39.82 91.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.931 -0.577 . . . . 53.15 110.993 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.429 HD22 ' HE1' ' A' ' 9' ' ' TRP . 9.1 mp -67.08 -37.05 83.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.109 -0.496 . . . . 72.32 110.958 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.869 HD11 HD21 ' A' ' 16' ' ' LEU . 3.8 mm? -67.78 -35.63 79.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.216 0.531 . . . . 65.51 110.411 176.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -64.51 -37.23 86.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.93 -0.577 . . . . 61.01 110.628 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -72.18 -31.88 66.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 74.21 112.19 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.8 HD11 HD13 ' A' ' 58' ' ' LEU . 25.1 pt -84.41 -12.92 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.598 -0.441 . . . . 62.41 110.751 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.28 34.85 4.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 72.53 113.534 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.427 ' CG ' HD12 ' A' ' 58' ' ' LEU . 81.0 t80 -74.49 126.51 30.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.893 0.378 . . . . 73.1 110.27 177.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.6 p . . . . . 0 N--CA 1.447 -0.595 0 CA-C-N 115.887 -0.597 . . . . 63.13 110.708 -178.042 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 54' ' ' ARG . 22.7 t-105 . . . . . 0 N--CA 1.457 -0.093 0 N-CA-C 110.182 -0.303 . . . . 71.44 110.182 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.462 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.5 tpt -55.73 -41.04 73.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.999 -0.546 . . . . 51.55 110.812 178.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -67.33 -53.8 26.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 73.22 110.392 -178.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -61.25 -32.04 71.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 65.24 111.172 -179.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.434 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.8 t80 -63.43 -41.3 98.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 72.32 110.24 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.479 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 35.1 mm-40 -62.47 -42.19 99.3 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.476 -0.329 . . . . 72.5 110.508 178.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.528 ' HB3' HD11 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -60.96 -49.63 76.66 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.168 0.509 . . . . 53.44 110.37 174.052 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.428 HD21 ' CD1' ' A' ' 58' ' ' LEU . 27.0 tp -56.4 -51.63 67.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.205 -0.907 . . . . 73.3 111.611 -177.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.479 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 49.4 mtpt -50.92 -54.28 25.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.226 0.536 . . . . 63.23 110.705 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.647 ' O ' ' HD3' ' A' ' 22' ' ' LYS . 13.4 t -62.43 -46.88 86.52 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.116 -0.947 . . . . 62.43 111.146 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.644 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 10.5 t80 -70.26 -43.24 70.91 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.627 -0.26 . . . . 72.12 111.544 -172.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.606 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 91.7 t -67.58 -38.44 80.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.987 -0.285 . . . . 51.03 110.821 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.477 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -59.46 -28.86 67.37 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.074 0.464 . . . . 74.54 109.935 176.684 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.647 ' HD3' ' O ' ' A' ' 18' ' ' SER . 5.1 mptp? -79.71 -66.83 0.82 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.87 -0.605 . . . . 63.4 111.586 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.433 ' CD2' ' HB3' ' A' ' 22' ' ' LYS . 85.1 m-85 -113.59 0.86 14.77 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.926 0.713 . . . . 75.34 112.926 -169.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.606 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 15.1 mmt85 64.52 9.28 4.92 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.006 0.522 . . . . 75.04 112.18 177.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.7 ptt180 -178.06 178.19 0.96 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.585 -0.524 . . . . 74.11 109.585 -174.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.644 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 8.9 m-85 . . . . . 0 C--N 1.326 -0.416 0 N-CA-C 109.411 -0.589 . . . . 72.12 109.411 173.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.419 HD21 ' HG2' ' A' ' 15' ' ' GLU . 29.8 p-10 . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.027 0.38 . . . . 73.03 112.027 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.575 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 95.3 mt -75.71 -34.48 60.38 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 112.685 0.624 . . . . 72.11 112.685 -173.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.03 -40.36 98.39 Favored Glycine 0 N--CA 1.451 -0.321 0 N-CA-C 111.559 -0.616 . . . . 73.3 111.559 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.15 -28.77 43.7 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.396 -0.907 . . . . 42.22 111.381 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.618 ' HH2' HD21 ' A' ' 58' ' ' LEU . 20.0 t90 -56.75 -55.86 28.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 71.14 110.914 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.516 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 8.3 p -63.4 -42.29 98.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.465 . . . . 70.03 111.152 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -65.2 -28.78 69.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.026 -0.533 . . . . 61.22 111.72 -177.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.5 m -83.86 -39.2 20.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.926 0.393 . . . . 65.0 110.835 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.61 -30.83 70.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.31 111.954 -178.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -53.93 -38.86 65.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.1 0.476 . . . . 64.33 110.598 177.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.516 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 3.5 tmmm? -71.21 -37.06 72.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.579 -0.737 . . . . 70.15 111.035 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.5 mmt -62.5 -39.95 95.14 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.04 0.448 . . . . 73.34 110.655 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.49 ' N ' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -70.29 -48.36 57.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.615 -0.72 . . . . 74.14 110.55 -175.742 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 51.4 pttt -63.09 -24.95 68.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.123 0.487 . . . . 61.35 110.422 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -87.42 -1.33 57.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.863 -0.608 . . . . 74.15 111.169 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 58.74 30.92 66.57 Favored Glycine 0 N--CA 1.452 -0.269 0 CA-C-N 116.053 -0.521 . . . . 75.43 113.308 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.07 -0.8 11.03 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.607 -0.349 . . . . 73.51 111.501 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.758 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -61.33 140.23 94.61 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.096 -0.502 . . . . 74.45 109.711 172.307 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.758 ' HD2' HD23 ' A' ' 50' ' ' LEU . 55.3 Cg_endo -73.83 150.21 43.88 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.23 1.954 . . . . 72.35 112.231 178.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -69.61 -30.19 67.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.42 -0.809 . . . . 72.23 110.36 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.655 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 6.4 m-20 -69.69 -51.78 31.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.547 -0.751 . . . . 74.22 109.846 -175.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.638 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -56.54 -53.53 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.963 -1.017 . . . . 71.44 111.147 179.147 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -65.69 -24.74 67.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.414 -0.357 . . . . 72.21 111.055 -176.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.99 -38.58 64.1 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.72 -0.474 . . . . 64.03 109.72 176.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 82.7 mt -59.34 -44.18 92.67 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.801 -0.636 . . . . 74.21 110.01 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.618 HD21 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -62.02 -43.01 99.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.665 -0.698 . . . . 71.12 110.876 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.42 -33.78 74.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.517 -0.311 . . . . 72.11 110.86 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -64.14 -41.24 97.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 62.33 111.418 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.423 HG13 HG11 ' A' ' 20' ' ' VAL . 13.1 pt -83.12 -5.95 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.884 0.374 . . . . 71.55 110.893 177.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.442 ' HA3' ' NH1' ' A' ' 24' ' ' ARG . . . 85.96 41.32 7.19 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.027 -0.606 . . . . 65.31 113.24 173.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.456 ' CG ' HD12 ' A' ' 58' ' ' LEU . 78.6 t80 -81.19 135.54 35.77 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.128 0.49 . . . . 74.05 110.856 178.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.5 t . . . . . 0 C--N 1.318 -0.796 0 CA-C-N 115.578 -0.737 . . . . 61.22 110.299 176.658 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.606 ' CZ2' ' HD3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.117 0 N-CA-C 108.913 -0.773 . . . . 71.24 108.913 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.456 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 18.4 mmt -57.73 -34.78 69.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.551 -0.75 . . . . 70.03 111.419 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.513 ' HE3' ' OE1' ' A' ' 15' ' ' GLU . 18.8 ttpt -66.85 -52.93 37.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.392 -0.367 . . . . 65.1 110.059 178.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.45 -34.9 77.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.839 -0.619 . . . . 51.54 110.862 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -59.04 -50.24 74.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 71.21 110.519 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -63.98 -35.93 82.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.386 -0.37 . . . . 70.42 111.422 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.513 ' OE1' ' HE3' ' A' ' 11' ' ' LYS . 32.8 mt-10 -73.21 -34.86 66.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.472 -0.331 . . . . 73.02 110.745 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.697 HD23 HD22 ' A' ' 58' ' ' LEU . 39.4 tp -73.08 -42.28 63.18 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.732 -0.84 . . . . 73.55 108.732 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -52.2 -49.3 64.17 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.054 -1.43 . . . . 75.32 110.965 174.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -62.74 -38.06 89.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 50.52 110.501 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.35 -39.91 62.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.669 0.271 . . . . 74.35 111.247 -175.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.27 -34.37 66.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.94 0.4 . . . . 73.1 110.291 174.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -71.15 -39.22 72.08 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.987 0.422 . . . . 74.22 110.08 175.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -65.06 -61.2 2.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.594 -0.73 . . . . 74.24 112.463 -177.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -122.54 -7.28 8.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.005 0.372 . . . . 73.13 112.005 -171.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 2.6 mmm180 64.55 99.79 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 O-C-N 123.527 0.517 . . . . 73.34 109.904 -173.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' HB3' ' O ' ' A' ' 24' ' ' ARG . 74.7 ttt180 67.28 172.16 0.26 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.781 -0.645 . . . . 75.01 109.634 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 . . . . . 0 C--N 1.323 -0.579 0 N-CA-C 110.35 -0.241 . . . . 62.11 110.35 -179.913 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 121.18 0.514 . . . . 74.24 110.666 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.79 -24.75 59.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 71.34 110.335 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.78 -37.79 92.97 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.3 -0.864 . . . . 51.23 111.668 175.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.35 -33.34 53.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.493 -0.861 . . . . 53.51 111.663 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -63.88 -47.23 81.47 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.088 0.47 . . . . 71.34 110.637 -179.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.0 p -71.61 -30.21 65.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.196 -0.457 . . . . 64.24 111.28 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -53.33 -38.89 63.63 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.096 0.474 . . . . 75.21 110.891 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.414 ' HA ' ' HD3' ' A' ' 43' ' ' LYS . 95.3 m -73.28 -39.87 65.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 65.44 111.257 178.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.436 ' OE1' ' HD2' ' A' ' 54' ' ' ARG . 31.8 mt-30 -85.41 -21.15 28.91 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.014 0.746 . . . . 75.44 113.014 -171.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.445 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -66.05 -27.91 68.45 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 43.52 109.497 175.012 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.445 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 16.4 mtpp -67.83 -50.45 56.62 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.233 -0.654 . . . . 74.52 109.233 172.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.698 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 18.1 mmt -55.39 -37.66 67.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.015 -0.993 . . . . 72.04 110.916 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.769 ' HB2' HD12 ' A' ' 50' ' ' LEU . 4.2 tmm_? -77.17 -41.24 42.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 61.22 110.749 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.47 -40.45 93.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.281 0.562 . . . . 74.35 109.633 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.473 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 4.3 tp-100 -70.52 -29.24 65.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.68 -0.691 . . . . 64.13 110.346 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.5 35.8 9.17 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.83 -0.7 . . . . 61.22 112.228 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.473 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 17.7 ptmt -124.24 3.51 8.52 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.57 0.211 . . . . 64.32 111.57 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.769 HD12 ' HB2' ' A' ' 45' ' ' ARG . 4.0 mt -62.38 140.29 96.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.026 -0.361 . . . . 72.15 110.026 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.719 ' HG2' ' HB3' ' A' ' 54' ' ' ARG . 66.5 Cg_endo -75.6 135.1 17.6 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.708 2.272 . . . . 55.54 111.862 175.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.544 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 27.8 p-10 -69.56 -24.74 63.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.826 -0.625 . . . . 72.42 111.414 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.613 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 29.1 m-20 -64.92 -51.77 60.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.758 0.313 . . . . 75.44 110.686 177.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.719 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -62.94 -42.1 99.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 74.43 110.37 175.48 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.544 ' HB3' ' HA ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -53.27 -40.8 64.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.593 -0.73 . . . . 71.11 111.017 172.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -69.13 -44.69 71.86 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.973 -0.38 . . . . 54.32 109.973 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 85.8 mt -55.22 -47.3 75.55 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.254 -0.43 . . . . 75.55 111.282 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.697 HD22 HD23 ' A' ' 16' ' ' LEU . 39.0 mt -71.52 -37.86 71.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.975 -0.557 . . . . 73.54 110.77 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -69.86 -24.53 63.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.208 -0.451 . . . . 72.11 110.908 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -42.81 70.74 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 116.062 -0.517 . . . . 73.43 110.446 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 15.4 pt -73.49 -33.86 40.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 120.914 0.388 . . . . 70.51 110.343 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 131.6 33.47 0.44 Allowed Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.454 -0.879 . . . . 72.43 113.368 173.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -87.17 102.45 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.29 0.566 . . . . 60.3 109.52 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.8 p . . . . . 0 N--CA 1.444 -0.734 0 CA-C-N 115.112 -0.949 . . . . 64.35 110.89 -175.837 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.363 0.125 . . . . 72.51 110.669 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.448 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 20.0 mmt -60.4 -39.96 89.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.065 0.46 . . . . 74.42 110.89 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 36.8 ttpt -69.5 -55.03 11.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 73.02 110.66 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -64.54 -33.35 75.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.706 -0.679 . . . . 73.4 111.933 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.434 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.7 t80 -59.08 -51.87 68.2 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 122.999 0.187 . . . . 74.42 110.503 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.814 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 73.6 mm-40 -59.6 -39.25 83.58 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.071 0.462 . . . . 73.11 111.016 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.525 ' CB ' HD21 ' A' ' 34' ' ' LEU . 52.8 mm-40 -66.15 -45.47 80.84 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 65.42 110.362 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.2 tp -62.98 -44.13 96.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.039 -0.528 . . . . 75.54 110.806 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.814 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.2 mtpt -50.99 -57.37 8.77 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.096 -0.502 . . . . 71.33 109.707 175.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -55.43 -42.76 74.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.049 -0.978 . . . . 61.12 111.951 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -62.67 -48.26 80.08 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.908 0.385 . . . . 65.24 111.353 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.715 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 32.9 t -72.3 -43.64 64.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.496 0.554 . . . . 75.52 112.496 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 17' ' ' LYS . 8.3 ppt_? -64.45 -15.76 61.26 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.954 -0.699 . . . . 75.32 110.848 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -87.25 -72.71 0.5 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.096 -0.502 . . . . 74.12 111.082 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -116.41 -6.87 11.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.32 0.489 . . . . 72.43 112.32 -170.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.715 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 12.1 mpt_? 66.05 13.71 9.23 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.851 0.46 . . . . 74.1 111.209 -176.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.7 ptt180 -161.94 175.61 11.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.586 0.231 . . . . 72.33 110.745 -175.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 73.1 110.744 175.969 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 . . . . . 0 CA--C 1.52 -0.174 0 N-CA-C 110.598 -0.149 . . . . 71.41 110.598 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.525 HD21 ' CB ' ' A' ' 15' ' ' GLU . 3.7 mm? -65.52 -32.01 73.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 74.45 110.642 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.19 -38.94 96.45 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.012 -0.614 . . . . 64.13 111.756 177.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.78 -31.53 35.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.33 -0.938 . . . . 74.22 111.561 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -58.79 -53.1 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.348 0.259 . . . . 75.42 111.063 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.7 p -62.25 -40.67 96.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.386 -0.37 . . . . 74.12 111.164 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -62.24 -45.58 92.67 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.871 0.367 . . . . 62.01 110.796 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.473 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 27.5 m -66.65 -38.38 86.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.894 -0.594 . . . . 72.23 110.856 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.595 ' HG3' HD21 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.93 -20.95 60.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.108 -0.497 . . . . 71.31 111.513 -177.169 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -59.78 -43.9 94.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.729 0.299 . . . . 70.14 110.473 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -64.78 -41.54 95.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.318 -0.401 . . . . 75.03 110.097 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.555 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 25.3 mmt -57.77 -41.55 82.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.905 -0.589 . . . . 74.43 110.414 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.548 ' HD3' ' C ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -69.84 -49.68 50.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.698 -0.683 . . . . 72.11 111.045 -178.604 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -75.88 -22.5 56.08 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.881 -0.328 . . . . 73.43 111.324 -173.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.54 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 17.7 tt0 -85.3 -8.72 58.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.041 0.448 . . . . 74.43 110.19 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.18 37.62 63.55 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.695 -0.684 . . . . 44.12 112.409 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 14.2 ptmt -131.95 12.45 4.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.058 0.392 . . . . 74.31 112.058 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -63.43 135.32 96.2 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 108.527 -0.916 . . . . 75.02 108.527 176.391 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.763 ' HG2' HH11 ' A' ' 54' ' ' ARG . 20.5 Cg_exo -69.12 138.79 40.75 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.835 2.356 . . . . 65.04 113.109 -177.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.477 ' HA ' ' HG2' ' A' ' 55' ' ' ARG . 89.1 m-20 -69.51 -31.07 69.09 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.842 -1.072 . . . . 74.01 110.136 176.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.62 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 13.1 t70 -71.26 -47.9 54.26 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.531 -0.759 . . . . 74.12 110.144 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.763 HH11 ' HG2' ' A' ' 51' ' ' PRO . 3.2 ttm105 -61.95 -42.73 99.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 64.03 111.12 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.477 ' HG2' ' HA ' ' A' ' 52' ' ' ASN . 18.4 ptp180 -66.44 -31.92 72.97 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 109.745 -0.465 . . . . 72.24 109.745 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.16 -37.97 75.33 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.255 -0.429 . . . . 44.51 110.216 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.5 mt -59.84 -38.83 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 72.43 110.391 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 54' ' ' ARG . 9.9 mp -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 75.42 110.655 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.33 -36.56 82.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.814 0.34 . . . . 63.43 110.793 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -67.59 -40.01 84.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 74.04 111.671 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.435 HG21 ' HG2' ' A' ' 17' ' ' LYS . 33.6 pt -76.31 -14.03 14.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 120.579 -0.448 . . . . 35.43 110.877 178.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 110.74 20.16 7.42 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.624 -0.798 . . . . 61.41 113.582 173.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -68.32 130.67 43.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.299 0.571 . . . . 71.5 110.603 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.441 -0.879 0 CA-C-N 115.203 -0.908 . . . . 73.02 109.801 179.817 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.588 ' HZ2' ' HA ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.504 0 N-CA-C 109.897 -0.408 . . . . 64.32 109.897 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.429 ' SD ' ' N ' ' A' ' 10' ' ' MET . 1.5 mpt? -60.78 -38.15 84.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.992 -0.549 . . . . 75.44 110.762 -177.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.7 OUTLIER -69.95 -48.45 58.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.79 -0.641 . . . . 75.44 109.939 179.767 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.427 ' ND2' HD21 ' A' ' 33' ' ' ASN . 6.0 m-20 -63.95 -35.83 81.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.996 -0.547 . . . . 64.34 110.673 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -61.62 -54.94 36.2 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 115.737 -0.665 . . . . 71.41 110.135 -177.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -62.57 -29.57 70.68 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.885 -0.326 . . . . 74.34 111.321 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 46.0 mt-10 -65.31 -39.46 92.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.054 0.454 . . . . 72.1 110.312 175.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -87.66 -35.14 18.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.765 -0.652 . . . . 74.43 109.734 -173.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -58.68 -47.73 83.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.527 -0.76 . . . . 64.53 110.568 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.3 t -69.97 -26.94 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.919 -0.582 . . . . 73.32 110.202 178.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.491 ' HE1' ' HA ' ' A' ' 26' ' ' PHE . 37.9 t80 -75.14 -52.26 11.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.175 -0.466 . . . . 73.11 110.547 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.623 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 8.2 p -62.85 -33.79 62.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 73.11 111.984 -176.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -76.17 -20.07 57.87 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.005 -0.434 . . . . 75.32 111.001 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.425 ' HD3' ' CE2' ' A' ' 23' ' ' TYR . 62.9 tttm -95.49 -55.32 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.647 0.261 . . . . 75.23 111.069 -179.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.425 ' CE2' ' HD3' ' A' ' 22' ' ' LYS . 84.6 m-85 -93.84 -18.9 21.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.715 0.265 . . . . 65.04 111.715 -173.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.623 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 30.3 mmm180 64.0 87.07 0.11 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.489 0.662 . . . . 72.3 110.618 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.439 ' H ' HG23 ' A' ' 20' ' ' VAL . 0.1 OUTLIER 68.89 176.19 0.27 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.417 -1.265 . . . . 72.41 111.208 -173.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.653 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 81.7 m-85 . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.529 -0.759 . . . . 73.44 110.455 175.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.427 HD21 ' ND2' ' A' ' 12' ' ' ASN . 9.6 t30 . . . . . 0 N--CA 1.463 0.208 0 CA-C-O 120.677 0.275 . . . . 50.44 111.654 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.653 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 87.3 mt -60.81 -37.74 82.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.342 -0.39 . . . . 75.31 111.655 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.74 92.17 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.983 -0.627 . . . . 74.32 112.014 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.68 -38.96 12.73 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.719 -0.753 . . . . 72.3 111.68 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -55.17 -42.34 73.05 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 122.779 0.431 . . . . 71.43 111.097 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.1 t -65.98 -39.41 90.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.034 -0.53 . . . . 62.41 110.553 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -70.31 -37.26 74.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 71.33 111.727 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.6 m -68.93 -45.31 71.15 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.134 0.492 . . . . 72.32 110.838 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.73 ' HG3' HD21 ' A' ' 50' ' ' LEU . 2.8 mp0 -75.89 -17.24 59.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.085 -0.507 . . . . 63.44 111.588 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.5 tpt85 -59.87 -34.98 73.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.385 0.612 . . . . 72.01 109.863 173.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -74.14 -48.25 30.65 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.134 -0.939 . . . . 74.21 111.086 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.721 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.3 mmt -63.25 -29.57 70.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.885 -0.598 . . . . 72.44 110.987 -177.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -61.32 -50.39 73.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.836 -0.62 . . . . 74.4 111.172 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.418 ' HB2' ' HE3' ' A' ' 46' ' ' LYS . 20.4 ptmt -77.2 -18.47 57.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.047 0.451 . . . . 64.23 111.038 -175.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -84.75 -13.77 50.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.099 -0.5 . . . . 52.42 110.492 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.99 25.49 75.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.926 -0.654 . . . . 42.31 112.176 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.459 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.0 ptmt -109.99 -0.95 17.91 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.104 0.478 . . . . 73.42 110.303 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.73 HD21 ' HG3' ' A' ' 41' ' ' GLN . 4.7 mt -62.2 140.79 96.17 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.59 -0.732 . . . . 72.15 109.917 175.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.487 ' HB2' ' HB3' ' A' ' 54' ' ' ARG . 23.9 Cg_exo -65.83 127.27 17.49 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.303 2.002 . . . . 75.12 110.747 172.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -59.04 -33.7 71.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.828 -0.623 . . . . 64.13 110.63 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.668 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 30.8 m-20 -65.5 -46.71 78.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.199 -0.455 . . . . 73.22 110.023 175.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.588 ' HA ' ' HZ2' ' A' ' 9' ' ' TRP . 31.8 tpt85 -56.42 -33.48 65.87 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.082 0.467 . . . . 74.24 110.869 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -73.15 -38.93 66.06 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.337 -0.392 . . . . 73.41 110.843 176.74 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.7 tp -76.34 -40.15 52.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.581 -0.281 . . . . 54.34 111.194 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 63.3 mt -59.31 -33.72 71.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.93 0.395 . . . . 74.54 111.042 -178.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.525 ' HG ' ' NH1' ' A' ' 54' ' ' ARG . 3.2 mm? -71.97 -43.86 64.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 71.34 110.446 176.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.039 -0.528 . . . . 64.33 110.26 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 59.7 mmtt -53.04 -46.94 68.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.467 -0.788 . . . . 70.23 110.991 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 7.4 pt -89.87 1.83 7.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.701 -0.681 . . . . 72.32 111.887 -174.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.21 24.44 8.95 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.323 -0.941 . . . . 51.43 113.666 174.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.45 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 34.9 t80 -89.41 101.45 14.13 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.535 -0.913 . . . . 74.14 108.535 173.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 C--N 1.318 -0.782 0 CA-C-N 115.281 -0.872 . . . . 62.04 111.916 -171.77 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 . . . . . 0 CA--C 1.524 -0.054 0 N-CA-C 110.14 -0.318 . . . . 72.12 110.14 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.457 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.5 tpt -63.54 -34.92 78.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.101 0.477 . . . . 73.53 110.182 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.417 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.86 -48.21 39.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 73.4 110.556 -178.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -67.55 -39.47 84.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 64.35 111.465 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -62.83 -42.78 99.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.117 -0.233 . . . . 74.33 110.834 -176.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.99 -42.75 97.1 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.084 0.469 . . . . 64.04 110.869 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.99 -36.61 82.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.688 -0.687 . . . . 71.12 110.57 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 tp -81.96 -33.84 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 72.34 109.903 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -57.11 -52.05 66.85 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.699 -0.682 . . . . 70.32 109.999 175.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 m -68.51 -31.08 70.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.328 -0.851 . . . . 74.51 110.84 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -70.44 -50.63 36.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.428 -0.351 . . . . 64.21 110.316 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.638 ' HA ' ' H ' ' A' ' 25' ' ' ARG . 71.8 t -68.74 -36.88 76.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 CA-C-N 116.634 -0.257 . . . . 63.03 111.078 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -31.61 72.91 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.676 -0.41 . . . . 75.3 110.89 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -94.41 -54.32 3.58 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.934 0.346 . . . . 74.3 111.934 -175.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -97.57 -9.38 27.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.605 0.24 . . . . 72.42 111.417 -175.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.595 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 25.5 mmt180 55.78 79.97 0.15 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.84 -0.618 . . . . 72.51 111.558 -174.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.751 ' HD3' HG12 ' A' ' 64' ' ' VAL . 22.6 mtt180 70.25 171.74 0.31 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.13 -0.941 . . . . 65.31 111.017 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 1.3 p90 . . . . . 0 C--N 1.324 -0.517 0 CA-C-O 121.235 0.54 . . . . 70.53 110.474 172.656 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.2 m120 . . . . . 0 N--CA 1.467 0.416 0 CA-C-O 120.848 0.356 . . . . 74.45 111.406 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.28 -33.47 73.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.533 . . . . 75.24 111.217 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.29 -49.79 73.92 Favored Glycine 0 CA--C 1.5 -0.869 0 C-N-CA 120.745 -0.74 . . . . 64.55 111.324 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.18 -31.24 71.81 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.561 -0.828 . . . . 43.05 111.139 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.648 ' HH2' HD21 ' A' ' 58' ' ' LEU . 7.7 t90 -56.17 -56.13 24.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.25 0.547 . . . . 64.41 109.954 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.3 t -71.19 -44.98 64.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.511 -0.768 . . . . 64.22 111.477 -177.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -57.68 -28.63 63.96 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.812 0.339 . . . . 65.15 111.635 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.1 m -84.38 -51.15 7.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.17 0.509 . . . . 71.02 111.162 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.522 ' HB3' HD11 ' A' ' 50' ' ' LEU . 61.1 mt-30 -76.6 -24.22 53.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.946 0.721 . . . . 74.35 112.946 -170.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.565 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 13.2 ttt180 -55.83 -42.53 75.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.474 0.654 . . . . 70.24 109.404 173.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -76.11 -32.13 59.03 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.577 -0.738 . . . . 61.12 110.075 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 14.8 mmt -60.53 -45.76 92.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.398 -0.364 . . . . 65.4 111.521 176.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.605 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -65.58 -33.15 75.23 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.824 -0.35 . . . . 73.32 110.766 -177.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.469 ' HB2' HH11 ' A' ' 45' ' ' ARG . 5.2 tmmm? -73.87 -36.66 64.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.471 0.653 . . . . 71.23 109.53 176.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -73.56 -14.98 61.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.338 -0.846 . . . . 74.05 110.653 -178.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.624 ' C ' ' HE3' ' A' ' 49' ' ' LYS . . . 82.26 21.75 60.1 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.071 -0.585 . . . . 71.44 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.624 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 0.1 OUTLIER -95.09 -14.23 24.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.621 . . . . 32.32 110.535 -177.38 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.73 HD23 ' HD2' ' A' ' 51' ' ' PRO . 3.5 mt -93.6 141.74 24.25 Favored Pre-proline 0 C--N 1.315 -0.902 0 CA-C-N 115.315 -0.857 . . . . 64.41 110.248 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.73 ' HD2' HD23 ' A' ' 50' ' ' LEU . 83.7 Cg_endo -85.16 161.01 11.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.634 2.223 . . . . 65.44 111.736 170.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -71.35 -24.15 62.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.894 -0.594 . . . . 74.04 110.064 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.12 -51.75 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.734 -0.666 . . . . 74.24 111.192 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.4 ttm180 -67.87 -49.19 63.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.085 0.469 . . . . 74.21 110.376 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.52 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -50.41 -36.59 33.67 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.388 -0.824 . . . . 73.13 111.324 177.532 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.3 tp -68.35 -42.96 78.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 75.3 111.096 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.0 mp -62.35 -34.32 76.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.806 0.336 . . . . 64.21 110.869 178.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.648 HD21 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -65.65 -38.95 90.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.372 0.606 . . . . 54.35 110.473 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.52 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 12.4 t70 -64.94 -38.1 89.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.89 -0.595 . . . . 62.24 110.332 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -63.51 -41.7 98.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.775 -0.648 . . . . 74.32 111.969 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.453 HD11 HD13 ' A' ' 58' ' ' LEU . 35.3 pt -76.27 -16.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.563 -0.455 . . . . 63.01 110.906 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.67 33.6 3.28 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.731 -0.747 . . . . 45.54 112.984 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.429 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 48.0 t80 -93.79 133.78 36.81 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.072 0.463 . . . . 64.04 110.51 178.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.751 HG12 ' HD3' ' A' ' 25' ' ' ARG . 14.3 p . . . . . 0 N--CA 1.444 -0.749 0 CA-C-N 115.782 -0.644 . . . . 61.54 109.87 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.499 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 23.8 t-105 . . . . . 0 N--CA 1.462 0.17 0 N-CA-C 111.866 0.321 . . . . 70.12 111.866 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.513 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 12.0 mmt -54.35 -37.82 65.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.088 0.47 . . . . 53.41 111.131 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -79.36 -49.09 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.965 -0.561 . . . . 71.1 110.243 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -52.71 -47.25 67.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.924 -1.035 . . . . 63.33 111.464 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -54.72 -51.94 64.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.861 -0.608 . . . . 70.14 110.934 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -66.72 -36.5 82.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 72.31 111.687 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.99 -36.53 69.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.178 -0.464 . . . . 74.41 110.631 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.455 ' O ' HD23 ' A' ' 16' ' ' LEU . 4.2 tt -77.36 -35.69 54.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.188 -1.041 . . . . 75.44 108.188 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.65 -42.09 74.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.785 -1.098 . . . . 63.04 110.395 174.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -74.85 -29.95 61.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.631 -0.713 . . . . 72.35 110.925 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -75.4 -46.18 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 73.35 111.435 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.567 HG11 ' HB ' ' A' ' 61' ' ' ILE . 8.1 p -65.25 -34.15 68.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.573 -0.285 . . . . 72.05 111.205 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -78.86 -16.42 57.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.137 0.494 . . . . 73.45 110.147 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -77.8 -67.43 0.73 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.805 -0.634 . . . . 74.15 110.986 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -116.86 12.98 14.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.621 0.23 . . . . 73.45 111.621 -176.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 16.1 mmt180 62.31 88.26 0.09 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.722 0.639 . . . . 72.41 110.733 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.475 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 tmt_? 70.57 166.0 0.29 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.581 -0.736 . . . . 55.15 109.317 -177.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.8 p90 . . . . . 0 C--N 1.32 -0.705 0 CA-C-O 121.151 0.501 . . . . 74.33 111.3 -179.72 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 . . . . . 0 CA--C 1.522 -0.111 0 N-CA-C 111.525 0.195 . . . . 72.34 111.525 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.1 mt -58.63 -42.56 88.54 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.738 0.304 . . . . 74.13 111.066 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -57.81 -42.99 94.84 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.078 -0.582 . . . . 74.34 111.956 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.79 -39.8 76.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.848 -0.691 . . . . 65.13 111.528 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -54.64 -48.97 71.63 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.483 -0.562 . . . . 73.43 109.483 176.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -64.07 -51.42 64.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.134 -0.939 . . . . 74.44 110.877 178.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -52.72 -44.71 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.363 0.505 . . . . 52.33 112.363 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 46.0 m -70.9 -45.23 64.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.158 0.504 . . . . 73.14 111.264 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.45 ' HG2' HD21 ' A' ' 50' ' ' LEU . 33.9 mt-30 -86.44 -12.58 48.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.764 1.024 . . . . 72.44 113.764 -171.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -73.74 -4.73 36.37 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.297 0.57 . . . . 72.04 109.952 174.026 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.743 ' HD3' ' HG3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -92.67 -47.78 6.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.504 -0.771 . . . . 63.31 108.982 172.299 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.754 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 12.5 mmt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.573 -0.739 . . . . 75.21 111.231 -175.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.649 ' HG3' ' N ' ' A' ' 46' ' ' LYS . 14.1 ptt180 -52.37 -49.34 64.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.991 -0.55 . . . . 74.45 111.519 -178.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.649 ' N ' ' HG3' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -82.2 -43.7 17.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.867 -0.606 . . . . 71.33 109.854 -175.513 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.743 ' HG3' ' HD3' ' A' ' 43' ' ' LYS . 10.9 mm-40 -60.91 -18.0 54.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.378 -0.828 . . . . 73.31 111.688 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.24 36.24 24.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.924 -0.655 . . . . 75.15 111.522 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.762 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.8 mmpt? -108.65 -10.25 15.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 71.5 110.066 -177.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.661 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 11.0 mt -75.38 142.6 75.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 74.11 111.226 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -70.92 137.92 33.06 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.745 2.296 . . . . 74.14 110.947 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.585 ' HA ' ' CG ' ' A' ' 55' ' ' ARG . 74.3 m-20 -63.82 -22.49 66.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.613 -0.721 . . . . 75.21 111.965 -177.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.764 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 20.2 m-20 -64.27 -52.74 57.18 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.445 -0.576 . . . . 64.33 109.445 179.179 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -63.8 -47.12 82.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.662 -0.699 . . . . 63.34 111.295 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.585 ' CG ' ' HA ' ' A' ' 52' ' ' ASN . 7.7 ppt_? -65.51 -23.65 66.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.003 0.43 . . . . 73.22 110.539 -175.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.6 tp -82.35 -37.43 25.68 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.816 -0.438 . . . . 62.2 109.816 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 41.4 mt -66.39 -43.75 84.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 73.2 110.538 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.407 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 94.7 mt -64.32 -44.07 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.128 -0.487 . . . . 54.23 110.621 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -68.88 -20.39 64.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.17 0.51 . . . . 75.11 110.353 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -79.55 -39.73 31.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.802 -0.635 . . . . 75.24 110.767 177.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.567 ' HB ' HG11 ' A' ' 20' ' ' VAL . 19.4 pt -80.99 -9.8 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.662 0.268 . . . . 72.03 111.366 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.76 6.44 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.624 -0.798 . . . . 43.05 112.816 175.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.407 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 85.6 t80 -84.07 120.48 26.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.09 0.471 . . . . 71.5 110.309 179.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--N 1.321 -0.652 0 CA-C-N 115.34 -0.845 . . . . 62.41 110.068 178.255 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.477 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 11.7 t-105 . . . . . 0 C--O 1.224 -0.273 0 CA-C-O 121.298 0.57 . . . . 60.03 109.981 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.542 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 15.2 mmt -66.1 -23.95 66.6 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.967 -0.561 . . . . 64.14 110.791 177.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 -51.49 9.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.065 -0.516 . . . . 74.11 110.379 179.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -78.1 -25.22 47.44 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.579 0.585 . . . . 71.33 112.579 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -62.46 -52.51 63.22 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 121.096 -0.242 . . . . 73.24 110.727 177.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 10' ' ' MET . 8.4 pt-20 -68.45 -25.26 64.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.349 0.595 . . . . 74.45 110.157 177.397 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' O ' HD11 ' A' ' 34' ' ' LEU . 12.2 tt0 -68.66 -31.83 71.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.363 -0.835 . . . . 70.35 109.844 178.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.559 HD22 ' CZ3' ' A' ' 37' ' ' TRP . 41.2 tp -88.81 -39.27 14.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.312 0.577 . . . . 75.12 109.571 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.472 ' HG3' HG21 ' A' ' 61' ' ' ILE . 59.2 tttm -53.29 -51.85 60.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.888 -1.051 . . . . 65.44 111.284 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.6 p -61.14 -33.53 73.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.68 -0.691 . . . . 43.41 111.463 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.555 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 14.5 t80 -75.38 -49.67 18.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.847 0.356 . . . . 75.13 110.389 -178.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.9 t -63.17 -36.18 74.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.177 -0.465 . . . . 63.42 110.666 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -53.83 -30.39 45.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.07 -0.514 . . . . 72.54 110.954 178.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -92.33 -56.03 3.19 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.879 -0.6 . . . . 73.14 112.042 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.94 -29.15 11.6 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 120.874 0.369 . . . . 65.54 111.113 -171.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.58 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.1 OUTLIER 62.3 104.28 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.218 -0.901 . . . . 71.13 110.192 -164.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.5 mmt180 77.79 153.3 0.14 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.572 -1.195 . . . . 73.41 111.625 -177.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.555 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 6.5 p90 . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 114.627 -1.169 . . . . 55.42 109.054 177.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 CA--C 1.519 -0.216 0 CA-C-O 121.329 0.585 . . . . 71.33 110.948 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.414 HD13 HD12 ' A' ' 16' ' ' LEU . 98.2 mt -74.37 -32.08 62.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.37 -0.832 . . . . 71.01 111.104 -174.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.489 ' HA2' ' HE2' ' A' ' 26' ' ' PHE . . . -61.19 -43.57 99.23 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.335 -0.936 . . . . 64.01 111.218 177.032 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.37 -30.73 66.61 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 110.986 -0.845 . . . . 50.31 110.986 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.719 ' O ' HG22 ' A' ' 40' ' ' THR . 2.1 t90 -63.79 -46.44 85.17 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.441 -0.577 . . . . 74.43 109.441 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.486 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.3 t -60.1 -45.42 93.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.089 -0.505 . . . . 73.54 110.324 176.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.423 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 74.4 m-70 -61.52 -32.43 72.48 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.277 -0.419 . . . . 65.51 111.988 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 37' ' ' TRP . 1.3 t -71.05 -39.28 72.36 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 120.438 -0.505 . . . . 52.23 110.049 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.18 -27.57 61.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.859 0.361 . . . . 51.01 110.646 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 39' ' ' HIS . 21.3 tpt180 -54.98 -44.23 74.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.67 -0.695 . . . . 70.21 109.435 171.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 40' ' ' THR . 20.7 mtpp -71.79 -57.03 4.7 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.09 -0.959 . . . . 70.24 110.406 177.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.712 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.0 mmt -54.63 -33.99 61.42 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.808 -0.633 . . . . 71.05 111.973 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.861 ' HB2' HD12 ' A' ' 50' ' ' LEU . 23.9 tpt180 -74.14 -47.98 32.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.738 0.304 . . . . 65.14 110.334 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.479 ' HB3' ' HE2' ' A' ' 46' ' ' LYS . 5.1 tmmm? -64.99 -29.95 70.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.173 0.511 . . . . 72.54 110.162 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -79.23 -20.72 47.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.843 -0.617 . . . . 74.0 110.647 176.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 77.34 49.76 7.17 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.684 -0.689 . . . . 43.21 113.165 176.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.63 ' HD2' ' SD ' ' A' ' 44' ' ' MET . 0.1 OUTLIER -143.32 11.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.951 0.405 . . . . 61.31 111.915 177.678 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.861 HD12 ' HB2' ' A' ' 45' ' ' ARG . 5.7 mt -69.78 140.97 89.46 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.06 -0.518 . . . . 71.35 110.329 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.504 ' HD2' ' CD2' ' A' ' 50' ' ' LEU . 76.8 Cg_endo -80.63 144.92 16.0 Favored 'Trans proline' 0 C--O 1.239 0.535 0 C-N-CA 122.805 2.336 . . . . 73.44 113.047 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -65.5 -44.72 86.16 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.846 -1.07 . . . . 70.54 111.749 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.701 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 8.6 m-20 -54.78 -52.5 62.4 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.313 -0.403 . . . . 74.55 111.528 -175.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.558 HH11 ' HB3' ' A' ' 54' ' ' ARG . 3.1 ttp-105 -57.01 -46.0 82.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 65.31 110.697 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.72 -50.15 69.02 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.041 -0.981 . . . . 73.02 109.968 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.1 tp -67.64 -34.38 76.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 55.42 111.618 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.4 mt -62.61 -31.86 72.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 75.3 110.874 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt -71.67 -36.98 70.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.065 0.46 . . . . 75.43 110.443 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.22 -33.93 72.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.211 -0.449 . . . . 72.31 110.545 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -69.42 -31.78 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 71.02 111.881 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 17' ' ' LYS . 38.9 pt -86.81 -7.13 10.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.653 -0.419 . . . . 74.21 110.903 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.21 22.81 12.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.659 -0.782 . . . . 71.15 112.77 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -82.9 108.12 16.0 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.246 0.546 . . . . 74.53 110.104 178.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.1 p . . . . . 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 73.24 110.641 -178.764 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.649 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 18.5 t-105 . . . . . 0 N--CA 1.46 0.04 0 CA-C-O 120.496 0.188 . . . . 75.04 111.278 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 45.2 ttm -58.25 -35.02 71.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.748 0.309 . . . . 73.2 110.875 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.6 tmmt? -69.36 -55.47 10.29 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.187 -0.46 . . . . 74.04 110.921 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.506 HD21 ' HA ' ' A' ' 9' ' ' TRP . 11.8 p30 -66.09 -32.69 74.29 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 120.513 -0.475 . . . . 75.23 111.206 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.592 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 36.3 t80 -63.71 -45.75 88.56 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.279 . . . . 74.33 110.672 -179.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.496 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 38.7 mm-40 -58.97 -35.1 72.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.812 0.339 . . . . 71.25 111.287 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -75.45 -40.03 58.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.257 0.551 . . . . 72.54 110.041 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.441 HD13 HD22 ' A' ' 34' ' ' LEU . 47.0 tp -64.5 -40.25 95.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.281 -0.872 . . . . 73.33 111.597 -178.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 13' ' ' TYR . 55.2 mtpt -51.32 -57.71 8.16 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.348 0.594 . . . . 65.51 110.388 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.1 m -63.06 -37.05 85.63 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.915 -1.039 . . . . 54.42 111.336 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.534 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 11.2 t80 -65.73 -47.16 76.27 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.932 0.396 . . . . 74.34 110.621 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 40.2 t -67.76 -34.37 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.207 -0.451 . . . . 72.42 111.193 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -69.76 -39.83 76.48 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 120.928 -0.309 . . . . 74.52 110.367 178.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.67 -52.59 11.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.391 . . . . 73.15 111.406 -174.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -96.31 -20.82 18.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.017 0.377 . . . . 74.35 112.017 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.624 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 18.8 mmt180 63.47 92.99 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 72.24 110.158 -169.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 15.1 ptt-85 61.18 169.84 0.1 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.542 -1.208 . . . . 74.01 111.298 -176.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.534 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 1.8 p90 . . . . . 0 C--N 1.323 -0.555 0 CA-C-O 121.517 0.675 . . . . 74.24 110.754 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.464 HD21 ' HB2' ' A' ' 12' ' ' ASN . 2.4 p-10 . . . . . 0 C--O 1.225 -0.214 0 CA-C-O 120.306 0.098 . . . . 71.21 110.769 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.441 HD22 HD13 ' A' ' 16' ' ' LEU . 81.1 mt -61.4 -38.93 88.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.816 0.341 . . . . 61.21 110.914 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.72 -42.97 96.63 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.895 -0.669 . . . . 72.04 112.358 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -82.21 -26.71 47.16 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.275 -0.964 . . . . 53.24 111.293 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 5.2 t90 -56.58 -56.43 21.47 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 122.951 0.5 . . . . 72.31 110.584 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.7 p -65.09 -37.06 86.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.839 -0.619 . . . . 72.34 111.579 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.448 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 24.1 m80 -73.62 -40.46 63.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 74.45 111.908 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.527 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 95.9 m -63.65 -38.07 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.006 0.431 . . . . 74.53 110.966 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.971 ' HG2' HD21 ' A' ' 50' ' ' LEU . 7.9 mt-30 -76.55 -9.62 58.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.237 -0.438 . . . . 64.14 112.089 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 39' ' ' HIS . 5.1 mpt_? -62.41 -38.98 91.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.658 -0.497 . . . . 75.43 109.658 171.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.527 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -72.37 -37.37 68.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.635 -0.711 . . . . 73.52 110.34 179.189 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.481 ' CB ' ' HG ' ' A' ' 50' ' ' LEU . 16.9 mmt -71.32 -34.81 70.9 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 52.0 110.635 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.2 ttt-85 -63.89 -45.27 90.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.45 0.643 . . . . 63.22 109.635 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.6 tttp -61.93 -49.09 77.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.541 -1.209 . . . . 61.12 111.146 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -63.77 -31.07 72.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.703 -0.68 . . . . 60.44 110.352 177.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.89 32.24 15.41 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.745 -0.661 . . . . 71.13 112.712 176.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 49' ' ' LYS . 12.5 ptmt -121.98 7.16 9.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.792 0.329 . . . . 61.24 111.025 -178.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.971 HD21 ' HG2' ' A' ' 41' ' ' GLN . 4.6 mt -60.02 138.81 90.99 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.825 -0.625 . . . . 72.14 110.656 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 32.3 Cg_exo -61.08 131.86 38.94 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.183 2.588 . . . . 74.32 112.965 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.411 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 8.0 t30 -72.18 -39.66 68.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.355 -0.838 . . . . 64.31 111.374 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.691 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 50.7 m-20 -58.29 -53.83 53.83 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.148 0.499 . . . . 64.14 110.069 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.543 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -59.44 -39.82 84.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.254 -0.884 . . . . 75.03 110.738 176.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 55' ' ' ARG . 11.4 ttt180 -55.85 -50.32 70.92 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.931 -0.577 . . . . 71.21 110.6 177.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -67.81 -36.24 80.06 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.467 -0.788 . . . . 75.23 110.548 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 59.4 mt -62.19 -33.59 74.84 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.259 -0.428 . . . . 75.01 110.822 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 54' ' ' ARG . 56.8 mt -71.47 -41.35 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.138 0.494 . . . . 73.3 110.377 178.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.96 -32.01 73.53 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.132 -0.485 . . . . 72.41 110.257 177.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -58.87 -47.64 84.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.879 -0.601 . . . . 65.12 111.668 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.57 HG21 ' HG2' ' A' ' 17' ' ' LYS . 30.2 pt -77.71 -9.72 12.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.839 0.352 . . . . 74.43 111.488 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.25 14.09 19.39 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.537 -0.839 . . . . 65.5 113.53 174.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -72.57 124.19 24.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.834 -0.432 . . . . 74.43 109.834 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 115.929 -0.578 . . . . 74.41 110.831 -176.638 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.485 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 2.9 t-105 . . . . . 0 C--O 1.226 -0.176 0 CA-C-O 120.415 0.15 . . . . 73.21 111.057 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.459 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.9 tpt -59.18 -41.03 87.5 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.25 0.548 . . . . 32.21 110.572 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -70.27 -57.86 4.4 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.257 -0.883 . . . . 73.13 110.791 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -54.38 -32.0 56.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.989 -1.005 . . . . 71.34 111.241 -179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.659 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 63.8 t80 -58.41 -55.27 37.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.23 -0.441 . . . . 61.24 110.655 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.788 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 68.2 mm-40 -64.5 -36.73 85.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 64.13 111.204 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.15 -45.73 83.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.151 -0.477 . . . . 72.34 110.09 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.22 -40.08 93.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 64.41 110.95 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.788 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.7 mtpt -52.95 -58.85 5.58 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.931 0.396 . . . . 62.54 110.438 177.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.6 m -62.36 -36.34 81.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.227 -0.897 . . . . 74.24 111.414 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.672 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 18.9 t80 -63.16 -48.38 78.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 74.34 110.461 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.573 ' HA ' ' H ' ' A' ' 25' ' ' ARG . 64.6 t -71.8 -38.69 66.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.421 . . . . 52.1 110.562 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -55.82 -46.4 78.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.698 -0.683 . . . . 70.41 111.632 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.19 -48.84 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.306 0.484 . . . . 71.3 112.306 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -100.32 -15.93 17.85 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.026 0.38 . . . . 63.54 112.026 -170.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.536 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 6.8 mmt180 65.08 95.28 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.678 0.611 . . . . 73.35 111.519 -175.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.573 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 50.86 -172.74 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.657 1.183 . . . . 65.3 112.577 178.265 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.672 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 59.8 m-85 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.08 -0.509 . . . . 55.21 110.78 -179.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 . . . . . 0 C--O 1.233 0.237 0 CA-C-O 121.582 0.706 . . . . 71.32 109.442 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.442 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 93.5 mt -59.74 -32.87 70.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.858 -1.065 . . . . 74.32 110.817 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.14 -39.47 97.18 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.019 -0.61 . . . . 75.11 112.143 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.6 -33.59 47.01 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.179 -0.768 . . . . 63.55 111.179 178.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.801 ' HZ2' ' HD3' ' A' ' 54' ' ' ARG . 38.0 t90 -58.94 -55.17 38.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.159 -0.52 . . . . 74.21 110.388 175.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.39 -43.0 99.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.257 -0.883 . . . . 60.24 111.428 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.31 -41.6 63.09 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.914 0.339 . . . . 75.44 111.914 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.5 m -73.98 -51.19 16.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.145 0.497 . . . . 72.34 111.407 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.623 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 30.4 mt-30 -85.71 -12.98 49.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.713 1.005 . . . . 73.01 113.713 -167.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.417 ' C ' ' HD2' ' A' ' 42' ' ' ARG . 6.2 ppt_? -64.59 -24.5 67.62 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.626 0.727 . . . . 75.14 109.544 173.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -78.77 -46.36 19.02 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.093 -0.958 . . . . 74.21 109.824 176.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.623 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 12.2 mmt -60.69 -31.03 70.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.542 -0.754 . . . . 64.4 110.512 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.427 ' HB2' HD12 ' A' ' 50' ' ' LEU . 23.5 tpt180 -59.11 -45.75 90.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.469 -0.787 . . . . 63.1 110.623 174.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.44 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 0.4 OUTLIER -71.33 -43.89 66.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.076 -0.511 . . . . 73.55 109.651 -179.058 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.437 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 45.7 mt-30 -65.63 -14.32 60.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.608 -0.724 . . . . 74.33 111.791 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.29 26.53 73.34 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.155 -0.545 . . . . 62.52 112.444 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.521 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.8 ptmt -110.35 -4.58 15.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.826 0.346 . . . . 52.23 111.001 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.592 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 3.9 mt -58.9 140.99 86.22 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.835 -0.62 . . . . 75.41 109.933 174.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 16.7 Cg_exo -69.81 131.26 20.79 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.881 2.387 . . . . 64.43 112.309 176.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.56 -33.97 72.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.399 -0.819 . . . . 73.54 111.001 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.721 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 19.1 m-20 -51.91 -53.46 40.64 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.483 0.658 . . . . 75.43 110.028 176.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.801 ' HD3' ' HZ2' ' A' ' 37' ' ' TRP . 33.1 ttm180 -68.14 -48.65 64.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.742 -1.117 . . . . 73.44 111.217 -179.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.4 ' C ' ' HD3' ' A' ' 55' ' ' ARG . 3.6 tmt_? -50.22 -41.48 50.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.518 -0.765 . . . . 71.04 110.987 176.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.38 -36.14 73.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.559 0.218 . . . . 74.23 111.119 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 75.6 mt -61.81 -43.14 99.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 44.01 110.698 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.23 -39.15 86.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.839 -0.619 . . . . 73.41 111.159 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.94 -28.83 64.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.103 0.478 . . . . 71.12 110.253 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.46 ' HD2' ' C ' ' A' ' 60' ' ' LYS . 0.4 OUTLIER -66.9 -46.21 75.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.932 -0.576 . . . . 72.4 110.279 178.922 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.503 HG21 ' HG2' ' A' ' 17' ' ' LYS . 42.6 pt -72.9 -23.07 20.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.551 -0.295 . . . . 73.03 110.966 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.89 32.4 3.09 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.508 -0.853 . . . . 63.23 112.933 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -74.79 130.23 39.09 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.031 0.443 . . . . 72.14 110.29 177.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 C--N 1.323 -0.568 0 CA-C-N 115.684 -0.689 . . . . 65.44 110.1 179.819 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.512 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.16 0 CA-C-O 120.755 0.312 . . . . 54.0 110.296 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 tpt -55.37 -43.27 74.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 62.53 110.321 177.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -66.6 -44.22 82.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.182 -0.917 . . . . 62.3 110.366 -178.773 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -65.64 -33.04 74.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.236 0.541 . . . . 74.24 110.787 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.431 ' CE2' ' HD2' ' A' ' 17' ' ' LYS . 91.5 t80 -63.99 -53.48 49.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 73.52 110.901 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -63.16 -32.27 73.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.273 -0.421 . . . . 74.45 111.336 -176.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 47.7 mt-10 -63.69 -42.4 97.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.821 0.343 . . . . 74.13 110.979 177.269 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.467 ' O ' HD23 ' A' ' 16' ' ' LEU . 4.4 tt -79.51 -36.19 38.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.898 -0.778 . . . . 64.42 108.898 -174.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.431 ' HD2' ' CE2' ' A' ' 13' ' ' TYR . 61.1 tttm -53.75 -44.79 70.28 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.694 -1.139 . . . . 72.53 110.879 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 58.4 m -82.25 -32.95 29.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.851 -0.613 . . . . 71.01 111.33 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -64.83 -47.25 78.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.819 0.342 . . . . 71.01 110.921 -177.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.521 HG11 HD12 ' A' ' 61' ' ' ILE . 8.7 p -65.61 -33.77 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.274 -0.421 . . . . 72.31 110.511 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.76 -25.27 62.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.234 0.54 . . . . 61.33 109.9 179.564 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -93.17 -56.07 3.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.612 -0.722 . . . . 65.41 111.553 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -90.54 -15.93 29.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.159 -0.473 . . . . 75.51 111.567 -174.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 9.6 mmm180 58.34 88.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.878 0.736 . . . . 71.5 110.556 -174.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.518 ' HG2' ' N ' ' A' ' 26' ' ' PHE . 37.8 ttt-85 67.24 167.34 0.24 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.698 -1.137 . . . . 72.31 111.117 -176.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.518 ' N ' ' HG2' ' A' ' 25' ' ' ARG . 52.7 m-85 . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 109.075 -0.713 . . . . 74.34 109.075 174.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 120.845 0.355 . . . . 60.02 110.784 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.474 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 82.4 mt -66.73 -30.94 71.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 72.35 110.803 176.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.54 -36.66 91.76 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.793 -0.923 . . . . 64.4 110.793 174.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.21 -38.12 63.26 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.173 -0.771 . . . . 70.03 111.173 174.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -56.27 -49.24 74.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.907 -0.405 . . . . 75.23 109.907 174.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.76 -51.26 70.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.622 -0.717 . . . . 72.14 110.635 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -56.71 -46.85 81.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 74.22 111.232 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.567 ' O ' ' HG2' ' A' ' 44' ' ' MET . 51.7 m -61.84 -42.58 99.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.222 -0.445 . . . . 72.13 110.926 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.78 -27.05 68.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 51.44 111.744 -175.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 42' ' ' ARG . 1.2 tmt_? -58.77 -36.99 75.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 71.4 110.217 177.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.438 ' CE ' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -84.07 -34.78 24.13 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.932 -0.307 . . . . 74.55 110.501 178.131 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.567 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.3 mmt -55.16 -38.94 68.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.269 -0.423 . . . . 74.21 111.413 -176.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.525 ' HB3' HD12 ' A' ' 50' ' ' LEU . 10.9 ptm180 -72.33 -34.5 68.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.728 0.299 . . . . 74.23 111.021 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.77 -30.41 59.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.231 -0.655 . . . . 73.32 109.231 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -77.25 -16.99 58.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.392 -0.822 . . . . 51.33 110.462 174.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 74.24 24.44 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.965 -0.561 . . . . 74.25 112.642 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' A' ' 49' ' ' LYS . 19.3 ptmt -109.13 -3.04 17.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.646 0.26 . . . . 54.02 111.455 -177.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.875 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -64.65 139.07 97.66 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.644 -0.502 . . . . 62.23 109.644 176.774 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.875 ' HD2' HD23 ' A' ' 50' ' ' LEU . 2.6 Cg_exo -78.56 124.22 6.28 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.678 2.252 . . . . 74.25 111.753 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -61.06 -31.14 70.8 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.612 -0.722 . . . . 41.01 109.835 175.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.727 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.2 m-20 -57.56 -52.39 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.495 -0.775 . . . . 65.23 109.671 174.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HG3' ' CH2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -67.42 -31.88 72.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 74.42 110.119 -178.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -60.9 -43.91 97.88 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.307 -0.627 . . . . 72.42 109.307 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 65.8 tp -72.48 -41.91 65.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.0 -0.546 . . . . 73.52 110.508 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 79.1 mt -58.03 -43.31 86.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.845 0.355 . . . . 73.44 110.466 177.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.676 HD12 HD11 ' A' ' 61' ' ' ILE . 21.2 tp -64.77 -44.56 89.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.675 -0.693 . . . . 53.24 110.403 -178.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -63.19 -38.01 89.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.156 -0.475 . . . . 72.5 110.322 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -70.84 -36.55 72.95 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.906 -0.588 . . . . 75.32 111.997 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.676 HD11 HD12 ' A' ' 58' ' ' LEU . 10.7 pt -74.56 -3.66 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.758 0.313 . . . . 54.53 111.75 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.6 20.06 8.37 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.311 -0.947 . . . . 43.52 113.497 173.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -87.54 119.72 28.11 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.199 0.523 . . . . 73.21 110.559 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.483 ' CG1' ' HD2' ' A' ' 25' ' ' ARG . 14.4 p . . . . . 0 N--CA 1.442 -0.836 0 CA-C-N 115.473 -0.785 . . . . 42.21 110.293 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 7.3 t-105 . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.398 0.142 . . . . 70.51 111.199 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.459 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -59.84 -31.2 69.52 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.119 0.485 . . . . 52.5 110.381 -179.193 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.68 -48.24 15.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.924 -0.58 . . . . 73.15 110.058 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -65.28 -32.89 74.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 116.326 -0.397 . . . . 73.33 111.792 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -65.77 -53.31 42.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.822 0.344 . . . . 73.44 110.195 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.738 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 65.3 mm-40 -61.21 -31.98 71.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.302 0.572 . . . . 74.25 110.032 176.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.21 -52.24 63.06 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.081 -0.963 . . . . 74.54 110.095 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.4 tp -61.04 -44.72 96.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.725 -0.671 . . . . 70.21 111.133 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.738 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.9 mtpt -51.49 -58.42 6.32 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.501 0.667 . . . . 54.33 109.881 176.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.9 m -61.79 -42.53 99.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.562 -1.199 . . . . 73.14 111.838 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.473 ' CE2' ' HB3' ' A' ' 26' ' ' PHE . 26.4 t80 -67.18 -46.59 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.63 0.252 . . . . 64.05 110.799 -176.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 t -66.46 -39.38 83.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.957 -0.297 . . . . 73.34 110.678 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -60.94 -25.71 66.98 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.007 0.432 . . . . 71.53 110.203 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -92.77 -58.34 2.38 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.257 -0.429 . . . . 75.11 112.141 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -100.81 -30.04 11.92 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.207 0.447 . . . . 44.22 112.207 -170.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.3 OUTLIER 64.27 94.65 0.05 Allowed 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 123.846 0.716 . . . . 71.34 110.461 -168.379 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.2 mmm180 75.61 168.31 0.27 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 114.316 -1.311 . . . . 73.02 111.185 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.546 ' CZ ' ' HB3' ' A' ' 34' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.322 -0.594 0 CA-C-N 115.523 -0.762 . . . . 75.41 110.067 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 120.931 0.396 . . . . 71.43 111.183 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 26' ' ' PHE . 3.6 mm? -74.37 -26.68 60.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.143 -0.48 . . . . 75.11 110.709 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.88 97.74 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.61 -0.596 . . . . 70.25 111.61 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.57 -35.62 75.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.866 -0.683 . . . . 73.23 111.479 176.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -60.04 -49.81 76.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 74.21 109.946 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.1 m -70.33 -33.23 71.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.739 -0.664 . . . . 75.34 111.928 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -53.42 -37.08 62.21 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.799 0.333 . . . . 73.34 111.309 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 39.7 m -77.95 -44.55 26.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.893 -0.594 . . . . 62.42 111.369 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 27.8 mt-30 -84.84 -19.23 32.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.43 0.9 . . . . 61.41 113.43 -170.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.65 -26.75 68.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.126 0.489 . . . . 73.03 109.936 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -70.55 -45.48 65.39 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.526 -0.761 . . . . 65.22 109.631 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.791 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.5 mmt -65.94 -33.51 75.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.766 -0.652 . . . . 73.31 110.774 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.649 ' HB2' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -68.43 -47.05 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 73.51 110.082 178.76 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.406 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 0.3 OUTLIER -63.54 -45.65 89.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.784 -0.643 . . . . 75.1 109.444 179.819 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.488 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 1.2 tp-100 -67.6 -31.01 70.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 72.54 110.909 -178.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.84 41.24 4.73 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.206 -0.521 . . . . 75.4 113.385 174.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HE2' ' HB3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -131.96 2.62 4.01 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 117.212 0.506 . . . . 64.03 111.455 177.654 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.791 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 5.1 mt -54.24 140.0 54.96 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.721 -0.392 . . . . 71.51 110.434 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.6 140.52 81.7 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 123.262 2.641 . . . . 73.44 113.002 178.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.485 ' O ' ' HG3' ' A' ' 55' ' ' ARG . 18.1 m120 -64.3 -29.05 70.15 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.057 -0.974 . . . . 74.33 110.754 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -70.26 -44.27 68.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.066 0.46 . . . . 74.02 109.828 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.447 ' HD3' ' HA ' ' A' ' 54' ' ' ARG . 26.5 mmt180 -59.17 -51.8 68.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 71.25 110.987 177.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -66.02 -27.58 68.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.314 -0.403 . . . . 74.33 110.452 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.32 -44.2 30.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.711 0.291 . . . . 72.41 110.503 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.1 tp -59.46 -45.89 90.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.977 -0.556 . . . . 71.22 110.822 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.532 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 10.5 mp -66.05 -45.0 82.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.903 -0.589 . . . . 50.42 110.472 178.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.12 -28.25 69.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.287 0.565 . . . . 65.43 110.56 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -53.55 19.3 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 115.792 -0.64 . . . . 54.14 110.959 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.0 pt -68.49 -19.86 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.682 0.277 . . . . 40.25 111.728 -176.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.98 22.72 4.14 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.591 -0.814 . . . . 65.24 112.601 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.532 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 45.3 t80 -83.78 103.7 13.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.416 0.627 . . . . 70.21 109.723 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.444 -0.771 0 CA-C-N 115.059 -0.973 . . . . 73.25 110.044 -179.811 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.563 ' HZ3' ' HZ2' ' A' ' 37' ' ' TRP . 25.6 t-105 . . . . . 0 N--CA 1.461 0.114 0 N-CA-C 112.584 0.587 . . . . 74.22 112.584 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.514 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.4 tpt -53.69 -39.03 64.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.235 0.54 . . . . 74.32 110.63 -177.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HE2' ' HB3' ' A' ' 11' ' ' LYS . 4.5 tmmm? -75.42 -41.93 54.76 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.637 -0.71 . . . . 72.44 110.199 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -59.0 -38.8 80.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.831 -0.622 . . . . 65.22 111.092 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -60.93 -48.18 83.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 74.45 110.371 177.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.664 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 70.6 mm-40 -64.68 -38.97 92.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 71.14 110.697 178.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.402 ' HG2' HD22 ' A' ' 33' ' ' ASN . 5.2 tp10 -60.28 -45.2 94.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.887 -0.597 . . . . 72.33 109.692 178.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.5 ' HA ' HD11 ' A' ' 34' ' ' LEU . 33.0 tp -58.95 -47.34 85.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 72.31 110.946 178.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.664 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.3 mtpt -54.99 -55.73 27.65 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.22 0.533 . . . . 71.53 110.765 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.8 t -55.74 -47.26 77.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.204 -0.907 . . . . 52.1 111.069 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.56 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 42.2 t80 -65.26 -46.78 79.13 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.274 -0.421 . . . . 74.11 111.292 -176.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.556 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 9.4 p -68.09 -32.56 56.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-N 116.311 -0.404 . . . . 62.43 110.896 -178.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.482 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.6 tmt_? -70.94 -19.08 62.61 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.199 0.524 . . . . 74.03 110.179 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -85.16 -61.51 1.75 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.939 -0.573 . . . . 65.52 111.445 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -97.13 -19.0 18.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.767 0.318 . . . . 73.13 110.777 -176.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.556 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER 60.81 93.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 65.34 110.546 -168.36 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.516 ' H ' HG23 ' A' ' 20' ' ' VAL . 63.0 ttt180 65.21 158.64 0.1 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.445 -1.252 . . . . 73.11 112.184 -172.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.56 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 11.2 p90 . . . . . 0 C--N 1.317 -0.829 0 CA-C-N 114.583 -1.19 . . . . 75.22 109.387 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.402 HD22 ' HG2' ' A' ' 15' ' ' GLU . 75.9 m-20 . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.081 0.467 . . . . 51.33 111.055 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.5 HD11 ' HA ' ' A' ' 16' ' ' LEU . 3.1 mm? -75.13 -24.9 58.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.947 -0.569 . . . . 51.01 110.26 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.49 -36.16 92.77 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.658 -0.701 . . . . 34.13 112.022 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.42 -36.45 49.66 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.564 -0.827 . . . . 61.03 111.661 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.563 ' HZ2' ' HZ3' ' A' ' 9' ' ' TRP . 3.7 m95 -58.91 -49.88 76.14 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.032 0.444 . . . . 71.01 110.596 175.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -61.18 -40.21 93.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.314 -0.857 . . . . 73.31 111.174 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -69.8 -46.66 65.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.144 0.424 . . . . 61.24 112.144 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.467 ' O ' ' HG2' ' A' ' 44' ' ' MET . 49.0 m -80.99 -57.52 3.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.429 0.529 . . . . 35.31 112.429 -172.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.13 -18.46 49.75 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.535 0.939 . . . . 73.35 113.535 -166.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 42' ' ' ARG . 5.4 tmm_? -65.23 -32.12 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.194 0.521 . . . . 64.31 109.821 176.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.0 ttmm -76.51 -46.05 28.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.734 -0.666 . . . . 54.31 110.551 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.542 ' HB3' ' HG3' ' A' ' 49' ' ' LYS . 11.6 mmt -59.92 -28.75 67.87 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.54 -0.755 . . . . 71.34 111.273 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 ttt180 -64.88 -48.94 72.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.032 0.444 . . . . 73.14 110.463 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.502 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 3.3 tmmm? -65.76 -34.7 78.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.354 0.597 . . . . 54.35 109.619 -179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -83.74 1.03 44.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.518 -0.764 . . . . 63.14 111.704 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 59.25 34.45 80.15 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 116.356 -0.384 . . . . 72.02 113.232 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 17.9 ptmt -119.21 1.9 11.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.161 0.505 . . . . 70.42 110.967 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 mt -61.77 142.22 94.83 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.325 -0.852 . . . . 61.43 110.113 172.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.529 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 26.0 Cg_exo -64.65 120.69 8.03 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.177 1.918 . . . . 75.01 111.038 169.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -56.58 -32.86 65.63 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.98 -0.555 . . . . 73.31 110.42 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -58.31 -41.3 84.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 61.33 110.57 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.529 ' HG2' ' HB2' ' A' ' 51' ' ' PRO . 18.7 mmt180 -62.1 -50.2 72.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 116.088 -0.506 . . . . 74.44 110.799 179.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -54.24 -37.81 65.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.778 -0.646 . . . . 72.35 110.521 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 tt -68.38 -53.1 26.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 74.42 110.366 178.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mp -60.71 -39.39 88.38 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.336 -0.393 . . . . 74.43 111.592 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.59 HD13 HD11 ' A' ' 61' ' ' ILE . 4.0 mm? -61.66 -40.09 93.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.996 0.427 . . . . 62.42 110.787 178.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -66.7 -35.74 80.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.278 -0.419 . . . . 72.33 110.595 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -64.51 -42.55 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 75.14 111.255 -178.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.59 HD11 HD13 ' A' ' 58' ' ' LEU . 6.8 pt -77.76 -17.05 14.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.741 0.305 . . . . 75.35 111.682 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 117.4 29.75 2.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.08 -1.057 . . . . 50.2 113.949 172.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -84.57 106.9 16.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.532 -0.544 . . . . 72.12 109.532 175.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 12.9 p . . . . . 0 C--N 1.322 -0.622 0 CA-C-N 115.626 -0.715 . . . . 61.45 110.892 -177.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.669 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 120.43 0.157 . . . . 75.55 110.844 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -38.01 85.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 72.03 109.705 175.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.434 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 25.1 ttmt -70.14 -49.42 50.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.493 -0.776 . . . . 55.02 110.097 174.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.462 ' HB2' ' HA ' ' A' ' 9' ' ' TRP . 74.1 m-20 -54.61 -46.4 73.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.19 -0.913 . . . . 75.25 111.511 -178.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.423 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 32.4 t80 -55.65 -48.0 75.71 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.923 -0.581 . . . . 61.45 112.039 -173.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 11' ' ' LYS . 17.1 pt-20 -68.78 -34.85 76.25 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.96 -0.296 . . . . 72.02 111.259 -175.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -76.03 -40.91 52.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.033 0.444 . . . . 75.31 110.121 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.571 HD21 ' CD2' ' A' ' 58' ' ' LEU . 38.2 tp -57.04 -54.17 49.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 55.12 111.723 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 13' ' ' TYR . 8.4 mtpm? -51.79 -52.47 48.76 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.426 0.631 . . . . 70.31 110.556 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.9 m -58.9 -44.62 91.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.506 -1.225 . . . . 62.22 111.597 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.685 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 7.8 t80 -67.41 -52.42 40.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 74.53 110.422 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.435 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 78.1 t -60.1 -33.91 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.426 . . . . 75.53 111.621 178.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 21' ' ' ARG . 1.6 tmt_? -61.41 -26.84 68.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.377 -0.374 . . . . 75.33 111.106 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -108.94 -52.8 2.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.458 -0.337 . . . . 73.31 111.379 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 88.4 m-85 -90.7 -15.61 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.749 0.278 . . . . 64.35 111.749 -174.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.515 ' O ' ' HA ' ' A' ' 63' ' ' PHE . 26.6 mmt180 75.06 -18.46 0.44 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.632 0.773 . . . . 74.42 112.861 -178.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.9 ptt180 177.16 174.0 0.45 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.858 -0.423 . . . . 74.4 109.858 179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.685 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 7.7 p90 . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 71.44 111.363 177.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t30 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.112 -0.699 . . . . 72.53 109.112 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.2 mt -63.64 -43.88 95.5 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.441 -0.8 . . . . 71.33 110.934 177.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -51.82 -42.5 53.24 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 120.838 -0.696 . . . . 31.41 112.743 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.94 -34.49 27.03 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.313 -0.946 . . . . 43.53 112.261 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.504 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 17.2 t90 -57.17 -49.26 76.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.983 -0.377 . . . . 75.12 109.983 177.191 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.664 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 42.3 t -58.34 -50.72 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.919 -0.582 . . . . 74.51 110.63 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -61.62 -37.51 84.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.929 -0.578 . . . . 74.53 112.257 -176.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 m -82.78 -36.28 25.79 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.902 0.382 . . . . 65.11 111.405 -177.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.799 ' HG3' HD21 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.58 -18.29 61.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 73.1 111.581 -176.447 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 38' ' ' CYS . 18.0 mmt180 -52.78 -47.63 67.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.354 0.597 . . . . 71.41 109.954 173.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 47' ' ' GLN . 1.2 tmmm? -70.29 -42.12 72.46 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.074 -0.967 . . . . 71.14 110.827 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.659 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.5 mmt -64.11 -35.85 82.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.233 0.54 . . . . 72.42 110.651 -177.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.595 ' CB ' HD12 ' A' ' 50' ' ' LEU . 2.2 tmm_? -69.42 -49.66 53.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.334 -0.848 . . . . 70.15 110.17 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.02 -31.58 68.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.157 -0.474 . . . . 63.51 110.646 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.524 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 4.1 tp-100 -72.74 -22.12 60.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.525 . . . . 61.21 110.575 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.42 37.52 27.39 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.728 -0.749 . . . . 64.44 111.98 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.524 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 19.2 ptmt -121.06 -1.3 9.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.189 0.519 . . . . 74.32 110.917 177.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.799 HD21 ' HG3' ' A' ' 41' ' ' GLN . 7.0 mt -68.97 142.58 93.5 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.768 -0.651 . . . . 64.43 110.09 172.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -73.67 138.32 26.35 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.0 2.466 . . . . 74.32 111.54 174.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -72.37 -34.8 68.22 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.161 -0.927 . . . . 75.11 112.457 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.628 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 36.0 m-20 -54.76 -51.86 64.38 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.872 0.367 . . . . 73.35 110.546 -177.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.669 ' HG3' ' CZ2' ' A' ' 9' ' ' TRP . 2.8 ttp85 -55.58 -38.88 69.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 70.51 111.301 177.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -59.8 -43.76 94.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.051 0.453 . . . . 72.41 110.539 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.33 -33.32 63.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.9 -0.591 . . . . 74.55 110.654 -177.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.2 mt -60.96 -36.45 79.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 72.5 110.633 177.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 54' ' ' ARG . 23.9 mt -63.61 -37.9 89.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 75.12 110.241 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.27 -25.91 68.26 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.942 -0.572 . . . . 73.4 111.187 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -36.19 56.06 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.405 -0.362 . . . . 73.41 110.932 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.4 pt -81.53 -12.22 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.82 0.343 . . . . 64.22 111.189 177.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.85 18.97 10.02 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.585 -0.817 . . . . 64.23 113.073 176.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.549 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 42.6 t80 -76.63 107.17 8.73 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.001 -0.74 . . . . 74.12 109.001 176.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.442 -0.866 0 CA-C-N 115.346 -0.843 . . . . 75.35 111.224 -175.36 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.478 0.974 0 CA-C-O 120.82 0.343 . . . . 74.33 110.361 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -114.58 -163.2 0.86 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.738 -0.467 . . . . 75.21 109.738 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -64.0 -46.7 83.37 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.793 -0.185 . . . . 71.21 110.698 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 59.98 -164.21 0.22 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.15 -0.477 . . . . 72.33 109.823 -177.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 74.7 mt -102.38 5.95 40.02 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.458 0.647 . . . . 73.43 109.478 177.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -97.92 37.77 1.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.155 -0.93 . . . . 63.11 111.171 -174.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -62.1 -37.73 94.95 Favored Glycine 0 N--CA 1.454 -0.15 0 C-N-CA 120.954 -0.641 . . . . 74.45 111.926 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -57.46 -48.85 78.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.79 0.328 . . . . 62.42 110.459 175.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.528 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 8.3 t-105 -56.01 -50.11 71.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.786 -0.643 . . . . 75.43 110.538 177.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.425 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.7 tpt -56.64 -45.54 81.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.136 -0.483 . . . . 73.22 110.958 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.3 tmpt? -68.36 -45.21 73.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 73.34 110.798 -177.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -69.62 -35.92 75.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.342 -0.39 . . . . 73.13 111.397 -177.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.44 ' CE1' ' HB3' ' A' ' 57' ' ' LEU . 44.4 t80 -59.29 -50.97 71.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.779 -0.191 . . . . 75.53 111.088 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.82 -25.05 64.48 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.817 0.342 . . . . 73.22 111.176 -178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.487 ' OE2' ' HG ' ' A' ' 34' ' ' LEU . 34.8 tt0 -72.18 -41.12 67.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.225 0.536 . . . . 62.22 110.107 177.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.538 HD12 HD22 ' A' ' 34' ' ' LEU . 7.1 tt -79.94 -31.51 40.05 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.878 -0.786 . . . . 65.45 108.878 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.692 ' HA ' HD12 ' A' ' 61' ' ' ILE . 85.4 tttt -55.68 -49.78 72.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.194 . . . . 74.43 110.371 174.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 m -72.75 -31.08 64.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.44 -0.8 . . . . 72.22 110.793 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.631 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 29.3 t80 -70.81 -46.99 61.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.459 . . . . 71.11 110.377 -178.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.914 HG22 ' H ' ' A' ' 25' ' ' ARG . 24.2 t -65.2 -34.27 69.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.358 -0.383 . . . . 65.11 111.688 177.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -58.5 -20.94 50.11 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.292 0.568 . . . . 72.11 109.983 175.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -100.48 -47.75 4.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.024 -0.535 . . . . 61.32 111.646 -176.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -111.49 -25.92 9.34 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.378 0.881 . . . . 74.33 113.378 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.872 ' HA ' HG13 ' A' ' 20' ' ' VAL . 3.0 mpt_? 60.21 92.03 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 109.908 -0.405 . . . . 70.32 109.908 -166.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.914 ' H ' HG22 ' A' ' 20' ' ' VAL . 33.3 ttt180 67.59 161.64 0.18 Allowed 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.75 0.786 . . . . 65.44 111.548 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.631 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 5.7 p90 -130.0 87.25 52.2 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 62.41 110.513 -179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.19 -20.51 62.77 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 123.097 2.531 . . . . 73.42 113.001 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -87.38 -49.9 6.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.464 -0.335 . . . . 62.52 110.269 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.499 ' OG ' ' HA2' ' A' ' 35' ' ' GLY . 7.8 t 65.38 81.79 0.2 Allowed 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.461 -0.791 . . . . 63.1 111.002 177.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.4 p -139.06 17.5 2.63 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.799 -0.637 . . . . 64.52 110.885 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.562 ' CD ' ' H ' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -98.31 14.45 27.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.169 -0.468 . . . . 61.41 111.897 -173.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 74.59 -83.41 0.79 Allowed Glycine 0 CA--C 1.518 0.245 0 C-N-CA 121.013 -0.613 . . . . 43.1 113.893 173.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -65.04 -55.57 18.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.607 0.242 . . . . 65.24 111.269 -172.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.538 HD22 HD12 ' A' ' 16' ' ' LEU . 77.7 mt -66.96 -34.26 77.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.847 0.356 . . . . 73.53 110.141 178.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.499 ' HA2' ' OG ' ' A' ' 29' ' ' SER . . . -59.29 -43.15 97.49 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.903 -0.665 . . . . 53.05 112.181 178.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.36 -39.15 57.77 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.839 -0.696 . . . . 63.12 111.417 178.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.492 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 6.3 t90 -60.15 -42.53 95.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.91 0.386 . . . . 73.53 110.444 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.5 t -66.14 -38.83 89.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.914 -0.585 . . . . 72.52 110.888 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.6 m80 -59.25 -47.86 83.79 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 73.14 110.64 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.49 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 9.2 m -67.22 -35.1 78.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.204 0.526 . . . . 72.12 110.571 176.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.492 ' HB2' ' O ' ' A' ' 37' ' ' TRP . 3.2 tp-100 -65.12 -28.37 69.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.567 -0.742 . . . . 74.31 111.675 -174.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -54.77 -46.5 74.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 75.31 110.939 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.558 ' HD3' ' H ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -74.04 -22.53 59.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.062 -0.517 . . . . 73.41 110.717 -176.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.491 ' CB ' ' HG ' ' A' ' 50' ' ' LEU . 25.7 mmt -67.09 -46.25 74.83 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.412 -0.588 . . . . 73.32 109.412 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.519 ' HB2' HD12 ' A' ' 50' ' ' LEU . 8.1 tmm_? -75.48 -35.68 60.8 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.272 -0.876 . . . . 74.51 109.819 179.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.512 ' HB3' ' HA ' ' A' ' 43' ' ' LYS . 1.7 tmtp? -61.0 -47.3 87.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.88 -0.6 . . . . 73.22 110.706 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -75.4 -31.86 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.142 -0.481 . . . . 74.31 110.873 -176.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.36 21.65 37.31 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.825 -0.702 . . . . 52.54 111.85 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.436 ' HD3' ' SD ' ' A' ' 44' ' ' MET . 13.8 ptmt -95.96 -5.1 42.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.095 0.474 . . . . 72.22 109.763 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' ' 45' ' ' ARG . 1.3 mt -57.43 138.95 81.03 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.047 -0.979 . . . . 63.45 110.163 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 3.5 Cg_exo -82.46 128.09 5.32 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 123.115 2.543 . . . . 71.5 111.191 174.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -61.13 -28.54 69.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.817 -0.629 . . . . 53.34 111.806 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -66.87 -46.11 76.0 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.071 0.463 . . . . 60.13 109.973 175.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.528 ' HG2' ' CH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -62.44 -41.57 98.83 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.005 -0.739 . . . . 73.11 109.005 176.267 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.582 ' HG2' ' CZ2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -62.0 -44.62 96.33 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.103 -0.953 . . . . 72.24 110.646 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.64 -41.99 74.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 52.21 111.724 -177.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.44 ' HB3' ' CE1' ' A' ' 13' ' ' TYR . 5.9 mp -57.87 -43.07 85.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.709 0.262 . . . . 55.43 111.709 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.513 HD22 ' NH2' ' A' ' 54' ' ' ARG . 9.3 mp -71.6 -33.38 68.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.87 0.367 . . . . 65.15 111.095 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -64.92 -38.37 90.73 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.225 0.535 . . . . 51.53 110.014 178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -69.86 -29.99 67.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.173 -0.921 . . . . 75.54 112.128 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.692 HD12 ' HA ' ' A' ' 17' ' ' LYS . 26.2 pt -84.61 -8.47 11.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 120.592 -0.443 . . . . 74.25 110.917 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.06 18.44 9.89 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.701 -0.761 . . . . 65.14 113.467 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -79.44 104.66 10.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.526 0.679 . . . . 70.12 109.732 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.447 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 13.0 p -80.43 136.69 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-N 114.945 -1.025 . . . . 74.14 110.881 -177.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.582 ' CZ2' ' HG2' ' A' ' 55' ' ' ARG . 76.5 m95 -89.32 -29.01 19.46 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.948 -0.569 . . . . 75.11 109.98 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 19.3 m 65.18 -179.47 0.18 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.203 -0.908 . . . . 53.54 111.139 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.5 mt -110.5 83.49 1.77 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.384 0.611 . . . . 63.34 109.618 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -82.37 -38.68 23.82 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.884 -1.053 . . . . 61.21 109.346 -177.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -93.39 95.66 9.44 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.029 -0.987 . . . . 72.24 109.206 174.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.6 t-160 -77.21 87.91 3.66 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.025 -0.534 . . . . 64.23 110.446 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -172.32 88.29 0.09 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.418 -0.81 . . . . 74.12 109.366 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.1 p80 -96.14 126.72 41.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.017 0.437 . . . . 74.3 110.213 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -87.38 -6.95 58.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.504 0.669 . . . . 63.32 109.255 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 53.0 t60 . . . . . 0 C--O 1.243 0.726 0 N-CA-C 108.288 -1.004 . . . . 73.51 108.288 175.333 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 109.774 -0.454 . . . . 75.54 109.774 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -152.7 37.7 0.52 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.035 -0.53 . . . . 63.21 109.744 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -59.42 104.46 0.27 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.765 -0.652 . . . . 61.5 111.186 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -88.64 173.11 8.8 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.828 -0.624 . . . . 72.23 111.113 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -96.22 76.81 3.03 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.341 -0.985 . . . . 64.44 108.341 170.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.403 ' C ' ' H ' ' A' ' 8' ' ' GLU . 56.1 tp60 -111.73 147.81 34.81 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.409 -0.814 . . . . 75.22 109.919 -174.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.0 29.81 1.84 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.098 -0.573 . . . . 44.23 112.157 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.403 ' H ' ' C ' ' A' ' 6' ' ' GLN . 6.3 tp10 -70.85 -13.47 62.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 109.876 -0.416 . . . . 51.32 109.876 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -62.95 -48.09 80.4 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.64 -0.504 . . . . 74.44 109.64 172.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.502 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 8.0 mmt -61.16 -40.34 93.48 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.067 0.46 . . . . 72.53 109.783 176.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -49.81 75.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.35 -0.841 . . . . 74.24 110.067 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.411 HD21 ' HB3' ' A' ' 33' ' ' ASN . 10.4 m-80 -57.04 -44.23 82.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 116.097 -0.501 . . . . 52.12 110.835 177.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.635 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 56.3 t80 -61.36 -52.25 65.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.849 -0.614 . . . . 74.03 110.578 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.824 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 50.7 mm-40 -61.62 -37.54 84.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.763 0.316 . . . . 62.42 110.797 179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -65.27 -42.34 93.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.272 -0.422 . . . . 64.24 110.105 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 58.5 tp -68.05 -37.31 81.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.913 -0.585 . . . . 62.23 110.82 179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.824 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 59.2 mtpt -55.42 -49.87 71.26 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.486 0.66 . . . . 73.03 109.408 172.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 21.3 t -59.72 -40.84 89.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.34 -1.3 . . . . 74.53 110.739 176.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.27 -37.72 88.49 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-O 120.904 0.383 . . . . 73.54 110.728 177.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.612 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 21.3 t -71.76 -40.64 69.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.785 0.661 . . . . 71.53 112.785 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 18' ' ' SER . 0.0 OUTLIER -65.29 -17.0 64.15 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 119.826 -0.75 . . . . 73.13 110.439 178.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.442 ' HG3' ' HD3' ' A' ' 21' ' ' ARG . 85.6 mttt -97.76 -64.48 1.04 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.957 -0.565 . . . . 71.5 111.654 176.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -110.62 -5.9 14.96 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.938 0.347 . . . . 73.33 111.938 -172.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.612 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 4.3 mpt_? 63.67 12.8 6.85 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.893 0.477 . . . . 53.31 110.759 -177.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . 39.6 ttt180 -170.38 168.78 7.82 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.744 -0.836 . . . . 73.15 108.744 -171.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.643 ' HE2' ' HB2' ' A' ' 38' ' ' CYS . 8.3 p90 -120.88 85.21 39.62 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-O 121.505 0.669 . . . . 71.22 109.89 174.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.39 -32.82 6.04 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.487 2.125 . . . . 54.02 111.817 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -129.04 105.45 8.2 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.713 -0.676 . . . . 74.35 109.532 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.1 m -73.58 99.19 2.99 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.165 -0.47 . . . . 70.32 110.6 -178.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.42 -39.21 93.87 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.167 -0.469 . . . . 74.33 111.325 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -98.19 153.44 18.47 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.256 -0.429 . . . . 63.03 110.717 -178.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.61 -20.13 69.72 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.758 -0.937 . . . . 54.23 110.758 173.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.411 ' HB3' HD21 ' A' ' 12' ' ' ASN . 77.3 m-20 -63.8 -55.93 19.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.29 -0.455 . . . . 73.21 110.524 176.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.628 ' HA ' ' HB2' ' A' ' 37' ' ' TRP . 94.1 mt -71.95 -27.35 62.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.054 -0.521 . . . . 71.24 110.408 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.6 -43.72 98.9 Favored Glycine 0 N--CA 1.446 -0.653 0 N-CA-C 110.604 -0.999 . . . . 74.35 110.604 173.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.23 -28.91 61.14 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 121.025 -0.607 . . . . 63.1 111.606 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.628 ' HB2' ' HA ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -55.94 -50.52 70.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.371 0.605 . . . . 64.22 109.52 174.07 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.643 ' HB2' ' HE2' ' A' ' 26' ' ' PHE . 48.6 t -64.73 -40.48 95.4 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.177 -0.92 . . . . 73.24 111.049 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 44.7 m170 -72.02 -54.72 9.04 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 111.943 0.349 . . . . 74.23 111.943 -175.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.1 m -63.99 -40.43 96.37 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.079 0.466 . . . . 75.02 111.148 -174.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.718 ' HG2' HD21 ' A' ' 50' ' ' LEU . 9.9 mt-30 -84.13 -11.24 56.95 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.105 -0.498 . . . . 43.54 111.686 -177.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.607 ' HB2' ' O ' ' A' ' 38' ' ' CYS . 6.1 tpt180 -62.45 -36.25 81.86 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.932 0.873 . . . . 74.32 109.291 174.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 71.6 tttt -73.63 -54.36 8.33 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.405 -1.27 . . . . 75.25 111.134 178.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.484 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.4 mmt -57.62 -38.42 74.95 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.996 -0.547 . . . . 71.23 112.021 -178.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.456 ' HB3' HD12 ' A' ' 50' ' ' LEU . 9.5 ptm180 -65.24 -32.39 74.03 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.995 0.426 . . . . 75.33 110.899 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -75.16 -43.8 50.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.42 0.629 . . . . 64.25 109.561 177.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.506 ' NE2' ' HG3' ' A' ' 49' ' ' LYS . 27.8 mt-30 -72.58 -30.13 64.13 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.09 -0.959 . . . . 72.22 111.831 -177.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.87 30.41 17.88 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.523 -1.031 . . . . 74.34 110.523 -171.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.886 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -102.35 -8.44 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 115.3 -0.45 . . . . 74.34 110.257 -177.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 41' ' ' GLN . 2.9 mt -63.33 139.02 97.51 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.603 -0.726 . . . . 74.51 109.51 179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.715 ' HD2' HD23 ' A' ' 50' ' ' LEU . 56.5 Cg_endo -75.71 145.19 28.82 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.105 1.87 . . . . 73.54 112.337 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.1 -30.4 70.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.347 -0.842 . . . . 52.54 110.264 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.694 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.7 m-20 -59.73 -51.01 71.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.914 -0.584 . . . . 71.04 110.828 176.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.469 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 2.3 tmt_? -57.31 -38.23 73.7 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.096 0.474 . . . . 64.31 110.018 -179.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttt180 -64.6 -49.58 70.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.797 -0.638 . . . . 71.44 110.475 177.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 tt -64.87 -40.02 94.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.352 -0.84 . . . . 74.41 110.13 -176.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.694 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.4 mt -55.12 -39.94 69.96 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.093 -0.503 . . . . 73.31 111.042 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 87.3 mt -61.85 -45.48 93.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.036 -0.529 . . . . 71.23 110.665 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -65.36 -33.42 75.92 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.972 0.415 . . . . 63.31 110.879 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.71 -36.14 75.65 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 115.929 -0.578 . . . . 74.34 111.16 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.696 HG21 ' HG2' ' A' ' 17' ' ' LYS . 19.5 pt -85.68 -26.57 6.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.594 -0.275 . . . . 62.44 111.524 176.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 109.97 33.85 2.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.548 -0.834 . . . . 60.5 112.797 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.607 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 77.8 t80 -72.31 135.21 45.88 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.877 0.37 . . . . 64.51 110.328 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 13.7 p -92.99 126.62 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-O 121.55 0.69 . . . . 71.12 110.554 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 76.3 m95 -92.18 32.02 1.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.583 -0.735 . . . . 73.35 109.967 -178.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 m 74.61 -47.42 0.63 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.516 -0.766 . . . . 74.13 110.665 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.499 ' H ' HD23 ' A' ' 67' ' ' LEU . 2.4 pt? -127.9 158.59 37.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.868 0.366 . . . . 75.24 110.112 175.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -107.45 -84.67 0.52 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.365 -0.606 . . . . 52.4 109.365 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -156.92 -171.79 3.79 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.417 -0.957 . . . . 64.24 108.417 178.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -98.35 58.97 1.31 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.72 -1.215 . . . . 71.13 107.72 169.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 -90.64 -57.75 2.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.769 -1.105 . . . . 62.43 111.589 -168.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.601 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 50.8 t-80 -133.4 72.34 1.48 Allowed 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.853 -0.339 . . . . 62.43 111.677 -174.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.601 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 28.8 t60 168.79 -85.01 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.413 -0.812 . . . . 72.44 109.798 170.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.4 ' H ' ' HB3' ' A' ' 73' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.244 0.805 0 CA-C-O 118.881 -0.58 . . . . 75.25 109.484 -178.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.6 ttm . . . . . 0 N--CA 1.479 1.018 0 N-CA-C 110.278 -0.268 . . . . 70.22 110.278 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 68.2 -75.83 0.06 Allowed 'General case' 0 CA--C 1.532 0.257 0 O-C-N 123.801 0.688 . . . . 74.5 112.06 176.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.778 ' HG2' ' HG3' ' A' ' 11' ' ' LYS . 36.5 mt-30 57.41 36.77 27.48 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 122.733 0.413 . . . . 70.21 111.378 -176.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 40.6 t-20 -61.85 146.73 48.79 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.939 -0.393 . . . . 74.21 109.939 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.61 ' H ' HD12 ' A' ' 5' ' ' LEU . 5.8 mp -52.4 -41.01 62.79 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.334 0.588 . . . . 64.3 110.031 176.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -95.18 15.15 19.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.476 -0.784 . . . . 74.01 111.01 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -141.41 28.95 2.3 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.733 -0.746 . . . . 45.53 112.136 -178.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -84.0 -14.67 50.14 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.95 -0.3 . . . . 73.12 110.466 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.474 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -58.27 -56.58 20.21 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.023 -0.732 . . . . 65.22 109.023 178.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 47.9 ttm -55.32 -33.81 63.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.796 -0.638 . . . . 52.42 110.871 178.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.778 ' HG3' ' HG2' ' A' ' 3' ' ' GLN . 0.4 OUTLIER -68.36 -53.98 20.36 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.56 -0.745 . . . . 72.11 110.471 -177.573 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.457 ' ND2' ' HA ' ' A' ' 9' ' ' TRP . 8.3 p30 -77.11 -20.06 56.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.75 0.309 . . . . 75.24 111.077 -176.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 17' ' ' LYS . 74.8 t80 -51.38 -43.78 61.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 74.22 110.137 173.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -62.91 -36.4 83.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.891 -0.595 . . . . 74.32 111.304 179.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.3 -44.1 92.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 73.03 111.237 178.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 16' ' ' LEU . 3.4 tt -79.14 -32.58 44.43 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 108.591 -0.892 . . . . 72.14 108.591 -176.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 13' ' ' TYR . 84.5 tttt -51.38 -51.91 50.49 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.729 -1.123 . . . . 73.3 110.511 174.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 21' ' ' ARG . 25.6 t -76.58 -34.62 58.42 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.495 -0.775 . . . . 74.54 110.685 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.55 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 3.1 t80 -66.0 -45.35 81.89 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.869 0.366 . . . . 73.32 110.861 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.551 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 7.7 p -65.75 -34.4 70.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.373 -0.376 . . . . 73.33 111.588 -176.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.457 ' C ' ' HD2' ' A' ' 21' ' ' ARG . 5.6 ppt_? -79.43 -16.39 56.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.352 0.596 . . . . 73.12 110.325 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.8 tptm -89.31 -53.72 4.43 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.694 -0.685 . . . . 75.22 111.137 -174.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -115.57 -10.36 11.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.8 -0.182 . . . . 75.22 111.364 -178.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.551 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 64.16 93.45 0.06 Allowed 'General case' 0 CA--C 1.518 -0.286 0 O-C-N 123.667 0.604 . . . . 75.34 110.126 -170.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.665 ' HD3' ' O ' ' A' ' 64' ' ' VAL . 57.0 mtm180 65.92 -174.69 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 114.569 -1.196 . . . . 74.3 110.551 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.787 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 2.9 p90 -127.49 81.39 70.22 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.785 -0.643 . . . . 74.24 109.819 171.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -66.46 107.12 1.16 Allowed 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 123.099 2.533 . . . . 50.45 112.169 -176.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 59.99 25.53 14.74 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.877 -0.601 . . . . 72.44 111.17 177.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.787 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 45.2 m -88.9 133.73 34.2 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.814 -0.63 . . . . 73.13 109.422 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.437 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 9.2 p -72.26 -42.67 65.35 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.514 -0.312 . . . . 71.22 110.947 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' CD ' ' H ' ' A' ' 32' ' ' GLY . 1.7 tm-20 56.3 -158.38 0.24 Allowed 'General case' 0 CA--C 1.532 0.255 0 O-C-N 123.691 0.62 . . . . 72.1 110.003 177.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.44 ' H ' ' CD ' ' A' ' 31' ' ' GLU . . . -130.38 -87.49 0.46 Allowed Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 111.248 -0.741 . . . . 70.24 111.248 176.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 37' ' ' TRP . 6.9 p30 -70.21 -38.68 75.32 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.461 0.171 . . . . 61.31 111.461 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.43 -28.31 59.31 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 120.869 0.366 . . . . 53.32 110.807 177.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.437 ' HA3' ' O ' ' A' ' 30' ' ' THR . . . -61.16 -45.59 96.24 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.689 -0.767 . . . . 74.24 111.53 178.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.03 -29.31 59.03 Favored Glycine 0 N--CA 1.449 -0.434 0 N-CA-C 111.143 -0.783 . . . . 65.31 111.143 176.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.466 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 2.7 t90 -58.16 -55.79 30.42 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.085 0.554 . . . . 73.22 110.508 178.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 41.5 t -62.32 -46.76 87.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.8 -0.636 . . . . 73.04 110.787 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.444 ' O ' ' HG3' ' A' ' 42' ' ' ARG . 10.3 m80 -57.43 -46.21 83.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.122 -0.49 . . . . 75.5 112.013 -178.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.3 t -70.65 -35.08 72.7 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.018 0.437 . . . . 62.52 110.848 -175.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.598 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 3.0 mt-30 -86.42 -21.39 27.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.23 0.826 . . . . 70.22 113.23 -172.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 39' ' ' HIS . 0.0 OUTLIER -69.17 -22.75 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.095 -0.642 . . . . 75.12 109.494 174.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 2.8 tmmm? -73.45 -30.41 63.17 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.359 -0.837 . . . . 70.35 109.952 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.598 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 13.4 mmt -67.62 -33.83 75.77 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.744 0.307 . . . . 74.3 110.39 174.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.739 ' HB2' HD12 ' A' ' 50' ' ' LEU . 17.4 tpt180 -72.98 -39.06 66.41 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.519 -0.472 . . . . 75.1 110.389 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt -56.93 -44.76 82.78 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.372 0.606 . . . . 72.21 109.602 173.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.496 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 47.7 mt-30 -64.83 -29.58 70.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.191 -0.913 . . . . 71.4 110.996 174.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.99 28.65 44.86 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.969 -0.634 . . . . 75.13 111.582 -176.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.496 ' HG2' ' HB2' ' A' ' 47' ' ' GLN . 18.3 ptmt -113.16 0.42 14.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.818 0.342 . . . . 73.24 111.025 -176.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.739 HD12 ' HB2' ' A' ' 45' ' ' ARG . 1.8 mt -58.81 139.94 86.32 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.81 -0.632 . . . . 75.41 110.207 179.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 4.3 Cg_exo -82.23 158.63 17.56 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 122.672 2.248 . . . . 73.53 111.486 173.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.5 t30 -71.08 -31.8 68.28 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 115.07 -0.968 . . . . 73.51 110.643 -179.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -50.6 -51.24 50.32 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.917 -0.583 . . . . 74.14 112.231 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.582 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 47.5 ttt-85 -60.92 -50.52 73.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.047 0.451 . . . . 72.42 110.451 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.408 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -64.89 -26.83 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.764 -0.653 . . . . 61.42 110.964 -178.57 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -77.11 -51.73 10.52 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.212 -0.449 . . . . 74.53 110.726 179.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 9.2 mp -58.99 -43.23 91.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.447 -0.342 . . . . 53.35 111.043 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.631 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 71.2 mt -62.24 -40.77 97.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.982 0.42 . . . . 75.34 110.31 178.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.408 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 15.6 t70 -57.68 -41.18 81.09 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.861 -0.609 . . . . 45.22 111.105 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.439 ' HD2' ' N ' ' A' ' 60' ' ' LYS . 1.6 mptp? -77.31 -28.93 53.4 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.756 -0.656 . . . . 74.32 112.589 -173.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 16.1 pt -82.85 -14.34 11.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 C-N-CA 120.269 -0.572 . . . . 71.14 110.89 176.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 112.16 23.52 5.48 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.37 -0.919 . . . . 33.23 113.532 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.631 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 32.6 t80 -88.58 103.8 16.24 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.344 0.592 . . . . 53.51 109.794 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.665 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 14.4 p -99.02 129.17 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 CA-C-N 115.205 -0.907 . . . . 72.03 110.775 -177.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -68.57 -29.42 67.96 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.332 -0.395 . . . . 72.12 111.236 -175.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 42.2 m 64.68 -177.71 0.17 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.78 -0.646 . . . . 71.42 111.865 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.548 ' H ' HD23 ' A' ' 67' ' ' LEU . 2.6 pt? -86.22 14.93 5.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.143 -0.481 . . . . 70.54 111.533 -176.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -80.16 2.6 23.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.193 0.521 . . . . 60.13 110.993 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -136.81 -51.16 0.67 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.375 -0.602 . . . . 63.13 109.375 173.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -95.86 105.64 17.67 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.11 -0.7 . . . . 73.42 109.11 175.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -81.91 169.13 17.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.929 -0.578 . . . . 75.22 110.693 -175.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -91.39 137.34 32.44 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.335 -0.617 . . . . 74.51 109.335 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -58.13 -35.6 71.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.894 0.378 . . . . 73.32 111.037 -176.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.16 -0.924 . . . . 73.43 109.469 173.45 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 120.751 0.31 . . . . 61.01 110.393 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -79.59 79.07 6.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.547 0.689 . . . . 71.13 111.381 -178.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -165.59 82.86 0.33 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.679 -1.146 . . . . 71.22 107.954 173.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -127.67 -1.97 6.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.43 -0.805 . . . . 74.13 111.671 -171.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 84.3 mt -75.28 -41.23 57.62 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.486 -0.325 . . . . 65.2 110.593 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 67.58 146.3 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.901 0.75 . . . . 62.04 112.26 -178.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 70.53 35.78 68.15 Favored Glycine 0 N--CA 1.444 -0.782 0 CA-C-N 115.511 -0.768 . . . . 74.11 113.029 174.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.451 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 8.4 tm-20 -63.59 -27.54 69.31 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 109.048 -0.723 . . . . 65.34 109.048 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.468 ' HZ2' HD13 ' A' ' 57' ' ' LEU . 6.2 t-105 -61.58 -48.63 80.1 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.908 0.385 . . . . 72.33 110.36 173.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 78.1 mmm -61.6 -29.88 70.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 74.05 110.42 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -78.26 -49.6 13.41 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.522 -0.763 . . . . 71.03 109.788 176.587 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 8' ' ' GLU . 2.0 t-20 -52.74 -35.67 56.44 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.194 0.998 . . . . 74.2 111.164 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.2 t80 -52.87 -39.41 62.6 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 114.979 -1.009 . . . . 73.51 110.833 -178.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -63.44 -43.24 97.97 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.139 0.274 . . . . 75.1 111.521 -177.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.406 ' HB3' HD11 ' A' ' 34' ' ' LEU . 3.3 mp0 -63.52 -40.45 97.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.002 0.43 . . . . 73.52 110.771 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 39.9 tp -78.65 -45.36 21.65 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.439 0.638 . . . . 74.4 109.321 -173.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -51.05 -51.02 57.35 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.442 -1.254 . . . . 63.52 111.353 178.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.0 m -70.41 -38.28 74.58 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.251 -0.886 . . . . 71.13 111.029 -176.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.413 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 17.2 t80 -76.36 -44.98 34.05 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 120.446 -0.502 . . . . 72.11 111.092 -173.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.682 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 54.5 t -61.4 -33.91 58.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.144 -0.48 . . . . 73.11 110.993 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.464 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -58.26 -29.26 65.65 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.112 0.482 . . . . 55.32 110.767 176.013 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -91.26 -61.58 1.63 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.225 -0.443 . . . . 62.43 111.703 -175.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 75.5 m-85 -101.59 -6.7 23.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.35 0.5 . . . . 64.23 112.35 -174.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.682 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 28.4 mmt180 68.43 -0.59 2.17 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.173 0.589 . . . . 71.11 111.684 -178.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 80.9 mtt180 -168.71 172.01 8.25 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.326 1.05 . . . . 72.04 108.722 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.589 ' HB2' ' O ' ' A' ' 29' ' ' SER . 10.2 p90 -126.93 86.07 59.63 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-O 121.345 0.593 . . . . 71.45 110.332 172.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_exo -71.02 -49.5 0.38 Allowed 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.855 2.37 . . . . 73.31 112.341 -178.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -102.95 -39.07 7.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.419 -0.355 . . . . 74.41 110.703 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.589 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 52.8 m -77.81 89.47 4.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.233 -0.44 . . . . 74.34 111.452 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 34' ' ' LEU . 4.9 p -83.44 -55.24 4.42 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.973 -0.558 . . . . 65.02 111.177 179.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 66.01 159.99 0.13 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.038 -0.528 . . . . 74.04 110.291 -176.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.84 -51.16 57.74 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.443 -0.884 . . . . 31.23 112.519 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.442 ' HB3' HD21 ' A' ' 12' ' ' ASN . 15.0 m120 -66.1 -55.27 17.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.562 -0.319 . . . . 72.45 111.792 -176.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 30' ' ' THR . 83.0 mt -71.9 -38.76 69.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.415 -0.357 . . . . 74.23 111.756 -173.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -58.95 -43.74 96.6 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.923 -0.656 . . . . 43.0 111.889 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.19 -34.77 54.49 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.382 -0.687 . . . . 64.2 111.382 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.506 ' HH2' HD21 ' A' ' 58' ' ' LEU . 9.0 t90 -54.34 -52.22 62.26 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.31 0.576 . . . . 72.43 109.831 174.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.485 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.1 t -62.49 -46.33 88.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.937 -1.029 . . . . 55.53 111.131 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 22.7 m170 -56.77 -45.56 82.04 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.832 0.308 . . . . 73.23 111.832 -177.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.456 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 91.6 m -65.07 -48.17 74.73 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.314 -0.403 . . . . 64.01 111.691 -179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -84.7 -24.41 28.95 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.217 0.821 . . . . 71.44 113.217 -170.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' C ' ' HD2' ' A' ' 42' ' ' ARG . 1.4 tmm_? -62.88 -33.34 75.09 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.731 -0.84 . . . . 73.04 108.731 173.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 40' ' ' THR . 62.3 tttt -61.88 -50.52 71.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.248 -0.887 . . . . 74.53 110.575 175.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.664 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.6 mmt -61.39 -34.0 74.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 75.32 110.848 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.02 -48.11 81.75 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.458 -0.571 . . . . 61.31 109.458 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.9 tttp -66.65 -49.32 66.58 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.287 -0.869 . . . . 74.13 111.054 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.437 ' NE2' ' HD3' ' A' ' 49' ' ' LYS . 26.5 mt-30 -60.79 -32.08 71.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.943 -0.571 . . . . 73.35 111.757 178.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.32 41.01 5.91 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.581 -0.819 . . . . 60.35 111.95 -179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.437 ' HD3' ' NE2' ' A' ' 47' ' ' GLN . 16.2 ptmt -133.31 11.47 4.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.014 0.435 . . . . 75.01 111.459 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.664 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 4.1 mt -64.79 141.24 98.28 Favored Pre-proline 0 C--N 1.319 -0.731 0 CA-C-N 115.88 -0.6 . . . . 63.43 109.808 175.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.69 134.84 31.42 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.72 2.28 . . . . 74.14 111.755 173.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -60.19 -39.48 86.7 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.378 -0.828 . . . . 72.32 109.942 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.637 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.8 m-20 -56.61 -43.72 80.45 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.729 -0.669 . . . . 65.43 110.44 176.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.7 tpp180 -62.5 -49.47 75.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.563 -0.744 . . . . 42.34 110.265 -178.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -51.73 -44.37 63.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.403 -0.817 . . . . 74.33 110.309 175.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.604 ' HA ' ' OD2' ' A' ' 59' ' ' ASP . 7.0 mp -64.7 -41.71 95.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.101 -0.5 . . . . 72.11 111.481 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.1 mt -53.19 -39.38 63.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.937 0.399 . . . . 65.54 110.648 178.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 4.3 mm? -68.48 -49.51 59.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.68 -0.691 . . . . 75.32 111.411 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.604 ' OD2' ' HA ' ' A' ' 56' ' ' LEU . 1.9 p30 -73.27 -20.56 60.8 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.154 -0.619 . . . . 73.11 111.03 -175.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -65.86 -41.4 91.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 120.784 0.326 . . . . 74.45 111.407 174.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 26.7 pt -84.61 -2.74 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 74.23 110.871 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.521 ' O ' ' HD2' ' A' ' 24' ' ' ARG . . . 97.23 22.89 15.79 Favored Glycine 0 C--O 1.228 -0.231 0 C-N-CA 120.76 -0.734 . . . . 34.21 113.609 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.593 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 72.1 t80 -75.05 133.31 41.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.473 0.654 . . . . 63.01 110.164 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.776 HG12 ' H ' ' A' ' 66' ' ' SER . 73.6 t -91.62 127.84 43.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.869 0 CA-C-N 115.058 -0.974 . . . . 72.42 110.715 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.4 ' O ' ' HB2' ' A' ' 66' ' ' SER . 94.6 m95 -101.16 20.51 15.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.835 -0.621 . . . . 73.23 109.842 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.776 ' H ' HG12 ' A' ' 64' ' ' VAL . 70.0 m 72.24 168.76 0.31 Allowed 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.362 -0.836 . . . . 64.12 110.644 -173.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.441 ' H ' ' HG ' ' A' ' 67' ' ' LEU . 0.5 OUTLIER -78.24 58.68 2.12 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.456 0.646 . . . . 75.53 111.804 -177.183 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -76.18 87.2 3.03 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.645 -0.707 . . . . 74.24 110.882 178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -135.6 136.92 41.44 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.072 -0.967 . . . . 72.34 108.883 175.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 29.5 m170 -74.75 126.22 30.42 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.201 0.524 . . . . 72.33 111.543 -175.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 9.9 p-80 -65.04 150.56 47.89 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.105 -0.952 . . . . 75.32 110.761 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -108.41 144.55 35.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.593 -0.521 . . . . 71.43 109.593 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -67.39 -53.09 32.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.989 -0.374 . . . . 65.32 109.989 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 52.5 t-80 . . . . . 0 C--O 1.251 1.174 0 CA-C-O 118.535 -0.745 . . . . 74.12 109.611 178.145 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.6 mtp . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.865 0.364 . . . . 74.52 110.634 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -130.09 -170.65 2.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.433 -0.349 . . . . 75.45 110.409 -178.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -80.81 84.28 6.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.996 0.903 . . . . 75.42 110.605 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.416 ' O ' ' HB2' ' A' ' 5' ' ' LEU . 26.3 p-10 -101.47 16.03 26.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.988 -1.006 . . . . 74.14 110.286 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 4' ' ' ASN . 94.3 mt 74.83 98.47 0.07 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.715 -1.13 . . . . 73.23 109.632 -175.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -104.01 170.21 8.05 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.392 -0.822 . . . . 75.32 110.174 -173.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -69.22 92.77 0.32 Allowed Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.189 -1.164 . . . . 54.3 110.189 169.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -60.08 -37.57 80.32 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 120.258 0.075 . . . . 71.35 111.188 -172.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.733 ' HH2' HH21 ' A' ' 54' ' ' ARG . 5.8 t-105 -59.33 -52.67 64.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.847 0.356 . . . . 72.33 110.429 175.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.503 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.1 tpt -56.88 -37.57 71.54 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.229 0.538 . . . . 61.32 110.29 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.444 ' C ' ' HD2' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.63 -46.91 51.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.64 -0.709 . . . . 72.52 110.594 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -56.82 -35.48 68.83 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.961 0.41 . . . . 65.24 110.767 178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -59.94 -50.71 72.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.002 -0.544 . . . . 72.32 109.896 176.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 6.4 mm-40 -63.87 -39.04 93.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.083 -0.508 . . . . 73.33 110.717 176.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -61.82 -37.05 82.96 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.855 -0.611 . . . . 74.14 110.282 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.764 ' HA ' HD11 ' A' ' 34' ' ' LEU . 10.0 tt -76.65 -43.21 39.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 65.35 111.016 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 58.2 mtpt -55.99 -57.02 13.87 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.329 0.585 . . . . 72.43 110.552 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.522 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 36.9 p -57.99 -30.2 65.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.853 -1.067 . . . . 74.25 111.322 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.54 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 34.8 t80 -70.62 -49.63 45.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.346 . . . . 72.51 110.305 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.2 t -59.63 -37.93 73.11 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.189 0 N-CA-C 111.777 0.288 . . . . 74.23 111.777 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.407 ' HG2' ' HA ' ' A' ' 18' ' ' SER . 19.7 ptt180 -74.71 -18.88 60.44 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.374 -0.53 . . . . 65.43 110.586 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 18' ' ' SER . 53.5 tttm -94.87 -46.38 6.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.274 -0.421 . . . . 64.25 111.335 -173.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -118.31 -19.69 8.83 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.148 -0.221 . . . . 73.25 111.33 -176.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.626 HH12 ' HA3' ' A' ' 62' ' ' GLY . 11.3 mmm180 65.85 98.5 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.232 0 O-C-N 123.778 0.674 . . . . 73.04 111.563 -178.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.414 ' HG3' HG12 ' A' ' 64' ' ' VAL . 0.6 OUTLIER 71.29 163.4 0.26 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.936 -1.029 . . . . 75.25 110.962 179.074 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.572 ' HE2' ' HB3' ' A' ' 38' ' ' CYS . 8.4 p90 -140.79 83.37 14.5 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-O 121.518 0.675 . . . . 72.21 110.81 175.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -83.33 96.47 0.8 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.909 2.406 . . . . 73.11 111.22 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.538 ' NZ ' ' HB2' ' A' ' 28' ' ' LYS . 8.0 mtmp? 69.63 18.73 7.56 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.008 -0.542 . . . . 54.31 111.084 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.477 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 19.1 m -68.85 -40.31 79.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.553 -0.294 . . . . 61.14 111.044 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.511 ' HA ' ' HA2' ' A' ' 35' ' ' GLY . 0.2 OUTLIER 55.83 30.96 16.74 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.905 -0.589 . . . . 73.52 112.387 176.87 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -93.29 145.17 24.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.267 -0.424 . . . . 54.32 111.657 -178.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.21 -159.33 33.21 Favored Glycine 0 N--CA 1.451 -0.339 0 CA-C-N 115.659 -0.7 . . . . 24.24 112.321 176.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -70.74 -20.33 62.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.296 0.57 . . . . 72.23 109.717 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.764 HD11 ' HA ' ' A' ' 16' ' ' LEU . 57.2 mt -64.13 -33.68 76.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.213 -0.903 . . . . 72.43 111.155 -178.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.511 ' HA2' ' HA ' ' A' ' 30' ' ' THR . . . -51.65 -43.22 53.29 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.934 -0.651 . . . . 72.33 111.985 172.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.04 -31.45 34.94 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.849 -0.691 . . . . 75.32 111.697 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.411 ' HB2' ' HA ' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -56.87 -50.54 72.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.901 0.382 . . . . 64.15 110.719 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.572 ' HB3' ' HE2' ' A' ' 26' ' ' PHE . 30.0 p -65.05 -30.34 71.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 72.52 111.118 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -63.61 -47.25 82.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.788 0.328 . . . . 73.03 111.08 179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.447 ' O ' ' HB3' ' A' ' 43' ' ' LYS . 23.5 m -77.62 -20.86 53.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.205 0.526 . . . . 52.32 110.945 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.524 ' HG3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -77.64 -25.82 50.02 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.553 -0.294 . . . . 70.24 110.972 179.667 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 12.3 mmt180 -54.1 -47.1 72.14 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.226 0.536 . . . . 71.21 109.599 172.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 40' ' ' THR . 28.1 tttp -51.54 -62.56 1.55 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.624 -1.171 . . . . 63.31 111.181 175.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.431 ' HE2' HG22 ' A' ' 40' ' ' THR . 11.8 mmt -55.81 -46.22 78.11 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.058 -0.519 . . . . 73.21 112.229 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.612 ' NH2' ' HG3' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -65.13 -39.33 92.9 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.342 0.497 . . . . 74.12 112.342 -170.681 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.445 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 62.9 pttt -80.21 -19.19 47.56 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 75.31 110.4 -179.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -89.77 -14.86 33.64 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.445 -0.798 . . . . 75.33 110.876 178.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 72.92 27.49 68.71 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.833 -0.622 . . . . 42.01 112.297 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -100.53 -12.8 18.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.76 0.314 . . . . 73.41 110.748 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 1.021 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.5 OUTLIER -60.03 139.12 91.0 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.86 -0.609 . . . . 70.23 109.661 177.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 1.021 ' HD2' HD23 ' A' ' 50' ' ' LEU . 39.9 Cg_endo -73.28 127.92 12.39 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.303 2.002 . . . . 74.31 112.671 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.413 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 32.4 t-20 -59.39 -37.39 77.85 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.001 -0.999 . . . . 71.44 109.876 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -56.1 -48.58 75.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.569 -0.741 . . . . 50.42 111.306 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.733 HH21 ' HH2' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -71.14 -26.24 62.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.266 -0.424 . . . . 73.22 110.118 -175.187 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.413 ' HB3' ' O ' ' A' ' 52' ' ' ASN . 25.4 ttm-85 -61.84 -39.97 93.67 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.155 0.502 . . . . 73.42 109.792 175.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.5 mp -70.2 -32.14 69.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.595 -0.729 . . . . 63.03 110.76 178.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 70.2 mt -63.72 -39.4 94.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.151 0.501 . . . . 75.44 109.8 176.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.745 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 82.3 mt -71.04 -33.43 70.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.842 -0.617 . . . . 44.53 110.17 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.49 -32.65 74.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 74.43 110.887 177.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -62.0 -40.44 95.67 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 54.13 111.608 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 11.2 pt -87.99 -12.38 10.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 120.855 0.359 . . . . 73.32 111.362 -179.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.626 ' HA3' HH12 ' A' ' 24' ' ' ARG . . . 102.79 25.86 7.41 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.69 -0.767 . . . . 74.1 113.623 174.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.745 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 56.2 t80 -76.33 104.96 7.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.484 -0.561 . . . . 74.2 109.484 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.414 HG12 ' HG3' ' A' ' 25' ' ' ARG . 6.6 p -80.43 151.93 4.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.674 -0.694 . . . . 74.05 111.133 -175.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -116.24 28.72 8.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.492 -0.322 . . . . 73.43 111.622 -175.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.1 m -62.79 -21.01 65.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.211 0.449 . . . . 63.2 112.211 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.423 HD12 ' N ' ' A' ' 67' ' ' LEU . 5.5 mp -91.96 7.61 41.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.78 0.324 . . . . 64.32 111.26 -176.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.612 ' HG3' ' NH2' ' A' ' 45' ' ' ARG . 21.2 tt0 -74.16 128.42 35.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.049 0.452 . . . . 64.23 111.246 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -72.11 143.56 48.97 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.336 -0.616 . . . . 62.33 109.336 177.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -67.4 -14.35 62.84 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.263 0.838 . . . . 73.43 113.263 -169.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 64.13 23.74 13.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.381 0.61 . . . . 74.24 110.897 174.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -104.76 160.37 15.04 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.202 -0.454 . . . . 70.14 110.308 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -89.49 124.72 34.76 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.345 -0.389 . . . . 64.31 110.739 -176.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 42.3 t-80 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.477 -0.773 . . . . 63.11 109.603 176.436 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 mpp? . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 120.501 0.191 . . . . 64.13 110.581 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -101.04 86.35 3.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.968 0.889 . . . . 74.21 109.107 171.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -94.57 -52.73 4.18 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.942 -1.027 . . . . 63.43 110.75 -173.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -91.88 115.83 28.39 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.808 -0.633 . . . . 72.21 110.383 -178.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 82.5 mt -97.59 145.84 25.88 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.753 -0.658 . . . . 72.21 110.378 -178.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.588 ' NE2' ' HB2' ' A' ' 8' ' ' GLU . 0.3 OUTLIER -140.42 124.71 17.71 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.36 -0.607 . . . . 74.34 109.36 179.285 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.9 64.24 3.7 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 121.229 -0.51 . . . . 41.25 112.607 -174.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.588 ' HB2' ' NE2' ' A' ' 6' ' ' GLN . 20.9 tt0 -77.13 -26.31 53.04 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 110.17 -0.307 . . . . 63.42 110.17 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -45.55 84.92 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.823 -0.806 . . . . 73.42 108.823 175.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 48.5 ttm -58.09 -40.87 82.19 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.219 -0.446 . . . . 62.34 110.017 176.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -58.05 -55.84 29.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.391 -0.822 . . . . 61.13 110.098 177.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.99 -39.42 81.76 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.449 -0.796 . . . . 62.31 111.171 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -59.4 -47.96 83.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.466 . . . . 75.31 110.824 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -64.31 -40.91 96.86 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 120.849 0.357 . . . . 61.22 111.119 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.691 ' HB3' HD21 ' A' ' 34' ' ' LEU . 16.5 mm-40 -62.67 -32.57 73.66 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.22 -0.446 . . . . 63.44 110.969 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.844 HD13 HD11 ' A' ' 58' ' ' LEU . 1.2 tt -84.79 -34.45 22.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.822 -0.807 . . . . 71.32 108.822 -178.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.2 tmtm? -55.38 -37.12 67.14 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.051 -0.977 . . . . 70.43 109.491 172.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -82.55 -27.65 31.49 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 73.13 110.951 176.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -75.27 -36.17 61.26 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.837 0.351 . . . . 75.5 110.843 -177.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.483 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 62.9 t -57.96 -38.02 64.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 73.21 110.276 173.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.532 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.5 tmt_? -76.03 -24.86 55.25 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.233 0.539 . . . . 74.21 109.944 176.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.436 ' HG3' ' CD2' ' A' ' 23' ' ' TYR . 24.5 tptm -71.66 -60.54 2.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.758 -0.656 . . . . 75.5 111.482 -176.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.436 ' CD2' ' HG3' ' A' ' 22' ' ' LYS . 58.2 m-85 -126.15 3.96 7.15 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 63.22 112.196 -177.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.483 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 26.7 mmt-85 61.39 93.95 0.04 OUTLIER 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.855 0.36 . . . . 74.21 110.802 -173.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.931 ' HG2' ' H ' ' A' ' 26' ' ' PHE . 40.2 ttt180 58.73 -169.57 0.13 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.618 -0.719 . . . . 74.35 109.927 -174.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.931 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 0.7 OUTLIER -141.25 140.02 20.15 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-O 120.746 0.307 . . . . 71.33 110.253 170.731 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.418 ' HD2' ' H ' ' A' ' 28' ' ' LYS . 4.8 Cg_endo -90.48 -26.47 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.895 0 C-N-CA 123.246 2.631 . . . . 62.53 110.989 170.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.418 ' H ' ' HD2' ' A' ' 27' ' ' PRO . 85.2 tttt -175.07 81.26 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.799 -1.091 . . . . 65.35 108.41 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.5 p -78.2 142.77 37.7 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.85 -0.614 . . . . 41.21 111.591 -173.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 16.9 p -122.17 5.02 9.78 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.852 -0.613 . . . . 52.02 110.473 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -93.61 109.99 21.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.751 -0.659 . . . . 65.11 111.325 -172.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 54.49 -138.89 39.8 Favored Glycine 0 CA--C 1.517 0.198 0 CA-C-N 115.265 -0.88 . . . . 75.34 114.167 173.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -64.04 -35.35 80.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.438 -0.381 . . . . 74.14 111.233 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.691 HD21 ' HB3' ' A' ' 15' ' ' GLU . 2.7 mm? -64.25 -28.55 69.81 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 74.45 111.062 -176.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -55.87 -44.77 87.36 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 74.42 112.062 174.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -83.08 -28.0 38.76 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.682 -0.771 . . . . 65.5 112.177 177.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.438 ' CH2' ' HG2' ' A' ' 41' ' ' GLN . 16.5 t90 -57.87 -50.55 72.92 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.707 -0.246 . . . . 72.43 111.02 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 26.8 p -59.85 -40.97 90.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.228 -0.442 . . . . 61.41 110.756 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -59.02 -46.1 89.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.724 -0.671 . . . . 73.53 110.73 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.8 m -76.16 -40.17 53.23 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.771 -0.65 . . . . 73.21 111.259 -175.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.438 ' HG2' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -78.7 -22.56 46.5 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.882 0.327 . . . . 53.24 111.882 -175.156 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.426 ' HD3' ' C ' ' A' ' 42' ' ' ARG . 0.5 OUTLIER -65.64 -33.22 75.39 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.702 -0.481 . . . . 73.0 109.702 176.379 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 33.4 mtmt -58.42 -52.49 65.4 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 116.04 -0.527 . . . . 72.43 109.971 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.735 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 9.6 mmt -58.56 -33.35 69.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.335 -0.848 . . . . 74.04 110.657 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -69.95 -39.94 75.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.689 -0.687 . . . . 61.13 110.197 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 25.7 tptt -72.24 -48.5 42.3 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.876 -0.602 . . . . 55.12 110.698 176.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -63.56 -22.22 66.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.658 -0.701 . . . . 73.1 111.747 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 76.25 29.92 57.75 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.682 -0.771 . . . . 64.24 111.479 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -113.75 3.15 15.43 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.8 0.333 . . . . 63.32 110.45 -178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.735 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 2.6 mt -59.65 138.26 89.78 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 115.689 -0.687 . . . . 63.41 109.376 175.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.505 ' HG2' ' HB2' ' A' ' 54' ' ' ARG . 81.5 Cg_endo -84.62 149.45 11.35 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.218 1.945 . . . . 64.44 112.333 176.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -70.98 -27.44 63.71 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.15 -0.932 . . . . 75.43 109.976 179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.55 -51.7 68.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.816 -0.629 . . . . 40.3 110.433 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.505 ' HB2' ' HG2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -63.87 -38.54 91.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 65.01 110.309 179.513 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -61.67 -45.94 91.87 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.038 -0.528 . . . . 61.1 110.563 177.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.3 tp -68.71 -42.27 77.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.387 -0.37 . . . . 65.44 111.55 -177.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.1 mp -58.36 -39.46 79.61 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.737 0.303 . . . . 72.44 110.86 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.844 HD11 HD13 ' A' ' 16' ' ' LEU . 4.3 mm? -71.14 -43.31 67.82 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.24 0.543 . . . . 74.45 110.765 177.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.92 -28.55 69.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.29 0.567 . . . . 64.34 110.231 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -74.61 -30.13 61.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.622 -0.717 . . . . 53.13 112.373 -179.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.771 HD11 HD13 ' A' ' 58' ' ' LEU . 27.2 pt -87.72 1.47 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 C-N-CA 120.519 -0.472 . . . . 61.21 111.101 179.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.88 16.31 31.19 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.449 -0.881 . . . . 73.32 113.021 175.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.55 105.44 1.51 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.062 0.458 . . . . 72.25 109.799 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.606 HG22 ' H ' ' A' ' 66' ' ' SER . 7.4 p -74.74 146.74 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.645 0 CA-C-N 115.419 -0.81 . . . . 54.24 110.413 -177.359 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -107.8 14.33 25.57 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.624 0.249 . . . . 74.41 110.401 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.606 ' H ' HG22 ' A' ' 64' ' ' VAL . 68.5 m 59.82 -147.95 0.46 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.758 -0.655 . . . . 64.52 110.012 -175.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mp -87.29 -179.87 6.49 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.47 -0.567 . . . . 75.24 109.47 174.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 63.19 72.12 0.49 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.478 0.656 . . . . 64.4 111.688 -175.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 66.2 m-70 -93.44 14.13 19.55 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.311 -0.859 . . . . 75.41 108.996 173.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -73.52 154.68 39.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.02 -0.991 . . . . 75.34 110.11 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -61.31 112.05 2.0 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.958 0.409 . . . . 73.04 111.097 177.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.5 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 84.7 m-70 -131.34 126.39 35.15 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.14 -0.689 . . . . 72.43 109.14 174.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.5 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 14.3 m-70 77.78 6.2 2.82 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.802 0.689 . . . . 73.55 111.962 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.465 -0.779 . . . . 71.13 110.13 -179.342 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.1 tpt . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 120.708 0.29 . . . . 63.34 110.222 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -121.38 149.93 42.25 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.81 -0.441 . . . . 73.33 109.81 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -129.02 151.81 49.3 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.457 -0.338 . . . . 73.11 110.558 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 m120 68.65 19.53 8.54 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.698 0.761 . . . . 72.14 110.67 172.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 47.5 tp -92.64 130.84 38.16 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.608 -1.178 . . . . 75.11 109.548 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -78.2 159.17 28.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.091 -0.504 . . . . 72.32 110.25 -178.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 72.69 36.68 58.13 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 110.778 -0.929 . . . . 74.25 110.778 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.601 ' HG3' ' HE2' ' A' ' 11' ' ' LYS . 17.5 tt0 -61.86 -29.74 70.39 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.541 0.21 . . . . 72.01 110.819 -177.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.431 ' CH2' ' HG2' ' A' ' 54' ' ' ARG . 19.1 t-105 -59.1 -49.33 78.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 74.41 109.88 173.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 49.4 ttm -61.6 -37.73 84.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.146 -0.479 . . . . 72.24 110.482 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.601 ' HE2' ' HG3' ' A' ' 8' ' ' GLU . 36.8 ttpt -56.93 -51.55 68.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.37 -0.832 . . . . 71.12 111.532 -178.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.422 HD21 ' HA ' ' A' ' 9' ' ' TRP . 11.1 p30 -78.18 -27.22 47.93 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.774 -0.37 . . . . 70.42 110.792 178.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -58.58 -46.05 87.78 Favored 'General case' 0 C--O 1.222 -0.39 0 CA-C-N 116.492 -0.322 . . . . 74.33 111.351 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -65.16 -35.18 80.28 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.701 -0.4 . . . . 45.32 111.233 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -70.73 -33.66 71.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.278 0.561 . . . . 72.33 109.932 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 58' ' ' LEU . 47.0 tp -80.89 -39.93 25.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.347 -0.842 . . . . 72.4 109.537 -177.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.0 tttm -55.6 -43.61 76.2 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.719 -1.128 . . . . 74.22 110.19 175.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.4 m -72.04 -34.93 69.17 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.492 -0.776 . . . . 72.04 110.425 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.658 ' HA ' ' HD2' ' A' ' 22' ' ' LYS . 32.0 t80 -71.82 -41.34 68.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.314 -0.403 . . . . 72.52 110.964 -175.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 56.7 t -65.68 -39.29 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.446 -0.343 . . . . 72.3 110.137 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -24.69 67.91 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.417 0.627 . . . . 73.4 109.847 176.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.658 ' HD2' ' HA ' ' A' ' 19' ' ' PHE . 42.0 mttm -77.53 -68.97 0.57 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.561 -0.745 . . . . 75.53 111.599 -178.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 45.8 m-85 -120.86 -15.24 8.37 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.027 -0.269 . . . . 75.53 111.518 -171.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 23' ' ' TYR . 1.1 mpp_? 70.72 111.53 0.06 Allowed 'General case' 0 CA--C 1.517 -0.293 0 O-C-N 123.947 0.78 . . . . 73.43 110.789 -171.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.626 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 22.0 ttt180 71.55 -178.25 0.21 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 114.724 -1.126 . . . . 75.43 110.23 177.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.514 ' H ' ' HG2' ' A' ' 25' ' ' ARG . 3.6 m-85 -105.53 86.55 1.79 Allowed Pre-proline 0 C--N 1.33 -0.24 0 N-CA-C 111.541 0.2 . . . . 64.11 111.541 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.626 ' HD3' ' O ' ' A' ' 25' ' ' ARG . 13.9 Cg_exo -70.01 -29.4 22.73 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 121.948 1.765 . . . . 72.0 110.658 173.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.644 ' HG3' ' H ' ' A' ' 29' ' ' SER . 0.1 OUTLIER -89.56 -61.05 1.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.036 -0.983 . . . . 75.03 111.213 177.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.644 ' H ' ' HG3' ' A' ' 28' ' ' LYS . 47.6 m 69.31 175.86 0.28 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.211 0.604 . . . . 65.21 111.067 -174.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 59.72 39.74 20.61 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.619 0.6 . . . . 64.3 112.619 177.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -143.22 141.46 31.09 Favored 'General case' 0 C--N 1.333 -0.147 0 O-C-N 122.307 -0.245 . . . . 74.54 111.387 178.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 67.56 -162.27 47.78 Favored Glycine 0 C--N 1.333 0.374 0 CA-C-N 115.86 -0.609 . . . . 70.51 113.023 175.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -69.99 -23.77 63.21 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.904 -0.776 . . . . 65.34 108.904 176.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.548 HD21 ' HB2' ' A' ' 16' ' ' LEU . 88.9 mt -66.06 -30.23 70.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.952 -1.022 . . . . 64.0 111.248 178.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -53.73 -40.93 64.97 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.058 -0.591 . . . . 64.51 112.151 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.47 -32.33 31.2 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.778 -0.725 . . . . 61.44 111.626 176.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.667 ' CZ2' ' HD3' ' A' ' 54' ' ' ARG . 26.2 t90 -54.15 -55.27 29.36 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.178 0.591 . . . . 71.31 111.126 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 7.1 p -67.12 -30.79 70.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.788 -0.642 . . . . 55.15 111.624 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -67.35 -36.47 81.47 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.763 0.282 . . . . 64.52 111.763 -178.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.0 m -72.08 -45.08 62.07 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.156 0.503 . . . . 52.44 110.885 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.46 ' HG2' HD21 ' A' ' 50' ' ' LEU . 19.3 mt-30 -80.68 -10.46 59.73 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.119 -0.491 . . . . 74.21 111.458 -176.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 42' ' ' ARG . 4.8 tpt180 -56.27 -28.89 60.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.597 0.713 . . . . 55.22 109.429 171.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 70.3 tttt -88.08 -58.24 2.64 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.723 -1.126 . . . . 61.42 111.076 177.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 10.4 mmt -56.7 -33.02 66.04 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.747 -0.661 . . . . 75.33 112.105 -172.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.654 ' HA ' HD12 ' A' ' 50' ' ' LEU . 4.0 tmm_? -58.1 -50.53 73.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.324 -0.398 . . . . 75.11 111.115 -175.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -81.73 -16.59 50.64 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.011 0.434 . . . . 72.53 111.158 -174.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -99.65 3.64 45.29 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.141 -0.481 . . . . 74.23 111.483 -178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 64.0 27.17 70.94 Favored Glycine 0 CA--C 1.517 0.208 0 C-N-CA 120.779 -0.724 . . . . 75.35 112.315 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.747 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.3 mmpt? -99.34 -6.52 27.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.158 0.504 . . . . 73.2 109.85 -178.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.8 HD23 ' HD2' ' A' ' 51' ' ' PRO . 2.2 mt -62.32 141.02 96.4 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 115.161 -0.927 . . . . 72.51 110.258 178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.8 ' HD2' HD23 ' A' ' 50' ' ' LEU . 64.5 Cg_endo -76.75 154.89 34.73 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 122.801 2.334 . . . . 62.12 112.997 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -71.76 -54.24 10.85 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.047 -0.979 . . . . 63.43 112.012 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -55.11 -34.88 64.06 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.023 0.44 . . . . 53.3 110.874 -175.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.667 ' HD3' ' CZ2' ' A' ' 37' ' ' TRP . 3.0 tmm_? -56.37 -42.85 78.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.403 -0.817 . . . . 73.51 110.134 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -67.0 -47.25 72.04 Favored 'General case' 0 CA--C 1.516 -0.346 0 C-N-CA 120.579 -0.448 . . . . 73.34 110.694 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.66 -39.82 91.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.931 -0.577 . . . . 53.15 110.993 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.429 HD22 ' HE1' ' A' ' 9' ' ' TRP . 9.1 mp -67.08 -37.05 83.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.109 -0.496 . . . . 72.32 110.958 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.869 HD11 HD21 ' A' ' 16' ' ' LEU . 3.8 mm? -67.78 -35.63 79.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.216 0.531 . . . . 65.51 110.411 176.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -64.51 -37.23 86.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.93 -0.577 . . . . 61.01 110.628 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -72.18 -31.88 66.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 74.21 112.19 -176.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.8 HD11 HD13 ' A' ' 58' ' ' LEU . 25.1 pt -84.41 -12.92 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.598 -0.441 . . . . 62.41 110.751 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.28 34.85 4.65 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.747 -0.74 . . . . 72.53 113.534 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.427 ' CG ' HD12 ' A' ' 58' ' ' LEU . 81.0 t80 -74.49 126.51 30.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.893 0.378 . . . . 73.1 110.27 177.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.6 p -88.31 133.86 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 CA-C-N 115.887 -0.597 . . . . 63.13 110.708 -178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 80.8 m95 -102.98 38.18 1.8 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.928 -0.578 . . . . 75.23 111.03 -176.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 37.1 p -86.73 110.3 19.81 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.097 -0.501 . . . . 54.41 111.031 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.7 mp -92.86 101.82 14.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.8 0.333 . . . . 72.14 110.525 178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.41 -30.23 13.5 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.589 -0.523 . . . . 70.12 109.589 176.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -80.25 105.06 11.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.741 -0.663 . . . . 74.44 110.394 177.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -109.85 -168.09 1.28 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.94 -0.573 . . . . 73.41 109.555 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -132.02 116.31 16.92 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.941 0.4 . . . . 63.23 111.521 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 9.6 m80 -95.21 128.0 41.7 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.502 -0.925 . . . . 65.23 108.502 167.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 64.7 t-80 -69.09 124.25 23.27 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.812 0.339 . . . . 74.43 110.603 -173.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.3 m80 . . . . . 0 C--O 1.248 0.991 0 N-CA-C 109.182 -0.673 . . . . 74.1 109.182 174.857 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 109.229 -0.656 . . . . 74.25 109.229 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -80.44 -26.78 38.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.364 -0.38 . . . . 74.43 111.795 -174.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -93.34 144.46 25.3 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.945 0.403 . . . . 73.1 111.256 -174.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -93.47 152.28 19.18 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.738 -0.838 . . . . 73.11 108.738 172.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.7 tp -154.5 154.3 32.91 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.207 -0.294 . . . . 64.5 110.207 -175.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -61.66 115.8 4.25 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.455 -0.572 . . . . 75.12 109.455 172.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 113.49 45.0 0.75 Allowed Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 110.054 -1.218 . . . . 44.45 110.054 -172.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.602 ' HG3' ' HE2' ' A' ' 11' ' ' LYS . 28.5 tt0 -86.31 -12.5 49.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.079 -0.561 . . . . 75.22 110.786 -174.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 54' ' ' ARG . 22.7 t-105 -55.55 -49.61 72.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.352 -0.386 . . . . 71.44 110.182 175.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.462 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.5 tpt -55.73 -41.04 73.3 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.999 -0.546 . . . . 51.55 110.812 178.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.602 ' HE2' ' HG3' ' A' ' 8' ' ' GLU . 33.0 ttpt -67.33 -53.8 26.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 73.22 110.392 -178.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -61.25 -32.04 71.85 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 65.24 111.172 -179.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.434 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.8 t80 -63.43 -41.3 98.69 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.392 -0.367 . . . . 72.32 110.24 178.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.479 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 35.1 mm-40 -62.47 -42.19 99.3 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.476 -0.329 . . . . 72.5 110.508 178.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.528 ' HB3' HD11 ' A' ' 34' ' ' LEU . 0.9 OUTLIER -60.96 -49.63 76.66 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.168 0.509 . . . . 53.44 110.37 174.052 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.428 HD21 ' CD1' ' A' ' 58' ' ' LEU . 27.0 tp -56.4 -51.63 67.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.205 -0.907 . . . . 73.3 111.611 -177.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.479 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 49.4 mtpt -50.92 -54.28 25.52 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.226 0.536 . . . . 63.23 110.705 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.647 ' O ' ' HD3' ' A' ' 22' ' ' LYS . 13.4 t -62.43 -46.88 86.52 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.116 -0.947 . . . . 62.43 111.146 -177.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.644 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 10.5 t80 -70.26 -43.24 70.91 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.627 -0.26 . . . . 72.12 111.544 -172.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.606 ' O ' ' HD3' ' A' ' 24' ' ' ARG . 91.7 t -67.58 -38.44 80.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 C-N-CA 120.987 -0.285 . . . . 51.03 110.821 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.477 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -59.46 -28.86 67.37 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.074 0.464 . . . . 74.54 109.935 176.684 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.647 ' HD3' ' O ' ' A' ' 18' ' ' SER . 5.1 mptp? -79.71 -66.83 0.82 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.87 -0.605 . . . . 63.4 111.586 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.433 ' CD2' ' HB3' ' A' ' 22' ' ' LYS . 85.1 m-85 -113.59 0.86 14.77 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.926 0.713 . . . . 75.34 112.926 -169.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.606 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 15.1 mmt85 64.52 9.28 4.92 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.006 0.522 . . . . 75.04 112.18 177.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.7 ptt180 -178.06 178.19 0.96 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.585 -0.524 . . . . 74.11 109.585 -174.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.644 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 8.9 m-85 -105.99 86.8 2.09 Favored Pre-proline 0 C--N 1.326 -0.416 0 N-CA-C 109.411 -0.589 . . . . 72.12 109.411 173.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.23 -48.79 4.31 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.663 2.242 . . . . 75.33 112.96 -173.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -78.48 -33.94 47.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.163 -0.471 . . . . 64.31 110.746 -176.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t 65.12 -159.91 0.28 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.493 -0.776 . . . . 72.35 108.924 -172.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 67.9 p 59.93 5.16 0.69 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.125 0.97 . . . . 72.53 112.551 -176.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.43 129.85 41.5 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.321 -0.992 . . . . 70.51 108.321 168.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -52.76 -73.7 0.37 Allowed Glycine 0 CA--C 1.518 0.266 0 C-N-CA 121.231 -0.509 . . . . 74.02 113.731 -173.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.419 HD21 ' HG2' ' A' ' 15' ' ' GLU . 29.8 p-10 -70.24 -47.18 62.52 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.027 0.38 . . . . 73.03 112.027 -175.372 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.575 ' HB3' ' CE1' ' A' ' 26' ' ' PHE . 95.3 mt -75.71 -34.48 60.38 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 112.685 0.624 . . . . 72.11 112.685 -173.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.03 -40.36 98.39 Favored Glycine 0 N--CA 1.451 -0.321 0 N-CA-C 111.559 -0.616 . . . . 73.3 111.559 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.15 -28.77 43.7 Favored Glycine 0 N--CA 1.444 -0.769 0 C-N-CA 120.396 -0.907 . . . . 42.22 111.381 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.618 ' HH2' HD21 ' A' ' 58' ' ' LEU . 20.0 t90 -56.75 -55.86 28.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.794 0.331 . . . . 71.14 110.914 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.516 ' HB3' ' CE2' ' A' ' 26' ' ' PHE . 8.3 p -63.4 -42.29 98.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.176 -0.465 . . . . 70.03 111.152 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 30.6 m170 -65.2 -28.78 69.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.026 -0.533 . . . . 61.22 111.72 -177.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 30.5 m -83.86 -39.2 20.2 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.926 0.393 . . . . 65.0 110.835 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.61 -30.83 70.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.283 -0.417 . . . . 74.31 111.954 -178.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -53.93 -38.86 65.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.1 0.476 . . . . 64.33 110.598 177.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.516 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 3.5 tmmm? -71.21 -37.06 72.08 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.579 -0.737 . . . . 70.15 111.035 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.5 mmt -62.5 -39.95 95.14 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.04 0.448 . . . . 73.34 110.655 175.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.49 ' N ' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -70.29 -48.36 57.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.615 -0.72 . . . . 74.14 110.55 -175.742 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 51.4 pttt -63.09 -24.95 68.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.123 0.487 . . . . 61.35 110.422 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -87.42 -1.33 57.85 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.863 -0.608 . . . . 74.15 111.169 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 58.74 30.92 66.57 Favored Glycine 0 N--CA 1.452 -0.269 0 CA-C-N 116.053 -0.521 . . . . 75.43 113.308 177.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.07 -0.8 11.03 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 122.607 -0.349 . . . . 73.51 111.501 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.758 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -61.33 140.23 94.61 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.096 -0.502 . . . . 74.45 109.711 172.307 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.758 ' HD2' HD23 ' A' ' 50' ' ' LEU . 55.3 Cg_endo -73.83 150.21 43.88 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.23 1.954 . . . . 72.35 112.231 178.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -69.61 -30.19 67.88 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.42 -0.809 . . . . 72.23 110.36 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.655 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 6.4 m-20 -69.69 -51.78 31.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.547 -0.751 . . . . 74.22 109.846 -175.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.638 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -56.54 -53.53 56.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.963 -1.017 . . . . 71.44 111.147 179.147 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -65.69 -24.74 67.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.414 -0.357 . . . . 72.21 111.055 -176.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.5 tp -73.99 -38.58 64.1 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.72 -0.474 . . . . 64.03 109.72 176.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 82.7 mt -59.34 -44.18 92.67 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.801 -0.636 . . . . 74.21 110.01 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.618 HD21 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -62.02 -43.01 99.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.665 -0.698 . . . . 71.12 110.876 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -68.42 -33.78 74.82 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.517 -0.311 . . . . 72.11 110.86 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -64.14 -41.24 97.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.226 -0.443 . . . . 62.33 111.418 178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.423 HG13 HG11 ' A' ' 20' ' ' VAL . 13.1 pt -83.12 -5.95 9.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 120.884 0.374 . . . . 71.55 110.893 177.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.442 ' HA3' ' NH1' ' A' ' 24' ' ' ARG . . . 85.96 41.32 7.19 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 121.027 -0.606 . . . . 65.31 113.24 173.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.456 ' CG ' HD12 ' A' ' 58' ' ' LEU . 78.6 t80 -81.19 135.54 35.77 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.128 0.49 . . . . 74.05 110.856 178.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.5 t -90.26 123.22 42.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.578 -0.737 . . . . 61.22 110.299 176.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -83.21 -26.47 30.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.165 -0.471 . . . . 64.53 110.229 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 49.8 m 65.33 120.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.6 0.714 . . . . 72.44 111.898 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 49.3 tp -99.8 130.88 46.04 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.944 -0.571 . . . . 52.32 109.801 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.87 133.67 43.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.085 -0.507 . . . . 65.33 110.691 -177.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -80.97 -178.68 6.99 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.933 -0.576 . . . . 63.13 111.892 -175.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -78.17 149.58 33.73 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.694 -0.685 . . . . 75.31 110.338 -177.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 45.7 m80 -93.27 152.61 19.07 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.52 -0.309 . . . . 54.1 110.265 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -85.56 71.58 10.73 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.241 0.46 . . . . 71.05 112.241 -170.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -175.73 150.04 1.01 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.715 -0.675 . . . . 52.45 109.534 173.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 58.9 m80 . . . . . 0 C--O 1.243 0.739 0 CA-C-O 118.271 -0.871 . . . . 65.25 109.785 175.63 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 110.44 -0.207 . . . . 75.04 110.44 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -142.63 148.58 37.66 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.847 -0.427 . . . . 72.21 109.847 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -98.99 50.72 0.96 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.732 -0.84 . . . . 70.13 108.732 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -75.75 -24.07 56.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.03 -0.986 . . . . 75.13 110.926 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.3 mt 63.4 -177.53 0.15 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.88 -0.6 . . . . 72.24 110.954 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 63.8 90.89 0.08 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.458 0.647 . . . . 71.05 110.864 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 141.08 54.91 0.04 OUTLIER Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.448 -0.882 . . . . 71.34 112.665 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -85.41 -17.87 35.36 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.05 -0.352 . . . . 74.25 110.05 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.606 ' CZ2' ' HD3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -51.04 -56.37 12.88 Favored 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 108.913 -0.773 . . . . 71.24 108.913 174.134 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.456 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 18.4 mmt -57.73 -34.78 69.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.551 -0.75 . . . . 70.03 111.419 -178.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.513 ' HE3' ' OE1' ' A' ' 15' ' ' GLU . 18.8 ttpt -66.85 -52.93 37.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.392 -0.367 . . . . 65.1 110.059 178.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -62.45 -34.9 77.72 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.839 -0.619 . . . . 51.54 110.862 -178.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -59.04 -50.24 74.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.267 -0.424 . . . . 71.21 110.519 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -63.98 -35.93 82.31 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.386 -0.37 . . . . 70.42 111.422 -179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.513 ' OE1' ' HE3' ' A' ' 11' ' ' LYS . 32.8 mt-10 -73.21 -34.86 66.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.472 -0.331 . . . . 73.02 110.745 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.697 HD23 HD22 ' A' ' 58' ' ' LEU . 39.4 tp -73.08 -42.28 63.18 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.732 -0.84 . . . . 73.55 108.732 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -52.2 -49.3 64.17 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.054 -1.43 . . . . 75.32 110.965 174.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -62.74 -38.06 89.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 50.52 110.501 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -74.35 -39.91 62.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.669 0.271 . . . . 74.35 111.247 -175.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -63.27 -34.37 66.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.94 0.4 . . . . 73.1 110.291 174.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -71.15 -39.22 72.08 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.987 0.422 . . . . 74.22 110.08 175.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mttm -65.06 -61.2 2.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.594 -0.73 . . . . 74.24 112.463 -177.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -122.54 -7.28 8.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.005 0.372 . . . . 73.13 112.005 -171.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.437 ' O ' ' HB3' ' A' ' 25' ' ' ARG . 2.6 mmm180 64.55 99.79 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 O-C-N 123.527 0.517 . . . . 73.34 109.904 -173.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' HB3' ' O ' ' A' ' 24' ' ' ARG . 74.7 ttt180 67.28 172.16 0.26 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.781 -0.645 . . . . 75.01 109.634 -172.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -72.15 151.71 92.48 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 110.35 -0.241 . . . . 62.11 110.35 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.38 91.97 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.323 2.015 . . . . 45.21 110.13 171.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.6 tmtp? 63.96 -74.26 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.44 -0.8 . . . . 64.11 109.578 -169.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.8 p -176.51 14.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.842 0.353 . . . . 45.23 111.12 178.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.9 p -92.81 54.9 2.3 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.283 0.475 . . . . 73.53 112.283 -172.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.481 ' O ' ' HA3' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -100.01 153.97 18.77 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.534 -0.543 . . . . 64.11 109.534 178.003 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -87.57 -76.54 1.27 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.939 -0.648 . . . . 73.24 112.383 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -63.71 -55.03 26.42 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.18 0.514 . . . . 74.24 110.666 -177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.5 mt -73.79 -24.75 59.88 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.592 -0.731 . . . . 71.34 110.335 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 31' ' ' GLU . . . -59.78 -37.79 92.97 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.3 -0.864 . . . . 51.23 111.668 175.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -75.35 -33.34 53.59 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.493 -0.861 . . . . 53.51 111.663 176.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -63.88 -47.23 81.47 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.088 0.47 . . . . 71.34 110.637 -179.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.0 p -71.61 -30.21 65.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.196 -0.457 . . . . 64.24 111.28 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -53.33 -38.89 63.63 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.096 0.474 . . . . 75.21 110.891 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.414 ' HA ' ' HD3' ' A' ' 43' ' ' LYS . 95.3 m -73.28 -39.87 65.03 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.83 -0.623 . . . . 65.44 111.257 178.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.436 ' OE1' ' HD2' ' A' ' 54' ' ' ARG . 31.8 mt-30 -85.41 -21.15 28.91 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.014 0.746 . . . . 75.44 113.014 -171.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.445 ' HD3' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -66.05 -27.91 68.45 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 43.52 109.497 175.012 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.445 ' N ' ' HD3' ' A' ' 42' ' ' ARG . 16.4 mtpp -67.83 -50.45 56.62 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 109.233 -0.654 . . . . 74.52 109.233 172.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.698 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 18.1 mmt -55.39 -37.66 67.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.015 -0.993 . . . . 72.04 110.916 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.769 ' HB2' HD12 ' A' ' 50' ' ' LEU . 4.2 tmm_? -77.17 -41.24 42.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.417 -0.356 . . . . 61.22 110.749 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.47 -40.45 93.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.281 0.562 . . . . 74.35 109.633 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.473 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 4.3 tp-100 -70.52 -29.24 65.68 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.68 -0.691 . . . . 64.13 110.346 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.5 35.8 9.17 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.83 -0.7 . . . . 61.22 112.228 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.473 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 17.7 ptmt -124.24 3.51 8.52 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.57 0.211 . . . . 64.32 111.57 -177.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.769 HD12 ' HB2' ' A' ' 45' ' ' ARG . 4.0 mt -62.38 140.29 96.5 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.026 -0.361 . . . . 72.15 110.026 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.719 ' HG2' ' HB3' ' A' ' 54' ' ' ARG . 66.5 Cg_endo -75.6 135.1 17.6 Favored 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 122.708 2.272 . . . . 55.54 111.862 175.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.544 ' HA ' ' HB3' ' A' ' 55' ' ' ARG . 27.8 p-10 -69.56 -24.74 63.75 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.826 -0.625 . . . . 72.42 111.414 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.613 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 29.1 m-20 -64.92 -51.77 60.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.758 0.313 . . . . 75.44 110.686 177.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.719 ' HB3' ' HG2' ' A' ' 51' ' ' PRO . 0.2 OUTLIER -62.94 -42.1 99.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.007 0.432 . . . . 74.43 110.37 175.48 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.544 ' HB3' ' HA ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -53.27 -40.8 64.94 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.593 -0.73 . . . . 71.11 111.017 172.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -69.13 -44.69 71.86 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.973 -0.38 . . . . 54.32 109.973 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 85.8 mt -55.22 -47.3 75.55 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.254 -0.43 . . . . 75.55 111.282 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.697 HD22 HD23 ' A' ' 16' ' ' LEU . 39.0 mt -71.52 -37.86 71.14 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.975 -0.557 . . . . 73.54 110.77 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.603 ' HB2' ' HE1' ' A' ' 65' ' ' TRP . 22.7 t70 -69.86 -24.53 63.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.208 -0.451 . . . . 72.11 110.908 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -42.81 70.74 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 116.062 -0.517 . . . . 73.43 110.446 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 15.4 pt -73.49 -33.86 40.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-O 120.914 0.388 . . . . 70.51 110.343 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 131.6 33.47 0.44 Allowed Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.454 -0.879 . . . . 72.43 113.368 173.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -87.17 102.45 14.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.29 0.566 . . . . 60.3 109.52 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 12.8 p -75.86 128.47 37.36 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.734 0 CA-C-N 115.112 -0.949 . . . . 64.35 110.89 -175.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.603 ' HE1' ' HB2' ' A' ' 59' ' ' ASP . 74.8 m95 -88.64 -31.73 18.4 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.639 -0.71 . . . . 74.31 110.846 -177.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.9 m 59.44 29.01 18.53 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.889 -0.596 . . . . 75.21 111.198 -179.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -78.67 86.23 4.65 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.385 -0.598 . . . . 62.51 109.385 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -98.27 82.21 2.88 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.587 -0.733 . . . . 72.31 110.544 -176.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -97.67 124.98 42.2 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.983 0.42 . . . . 75.34 110.469 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -78.74 139.38 38.45 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.834 -0.621 . . . . 55.24 110.316 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -76.46 157.0 32.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.858 0.361 . . . . 71.0 111.24 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -154.0 148.06 25.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.958 -0.565 . . . . 74.44 109.601 174.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 24.2 t-80 -115.26 -11.77 11.91 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.412 0.625 . . . . 70.33 109.34 176.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 . . . . . 0 C--O 1.249 1.052 0 CA-C-N 115.321 -0.854 . . . . 75.02 109.377 176.587 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.4 ttm . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.124 -0.324 . . . . 73.51 110.124 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -135.53 114.18 11.82 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.671 0.272 . . . . 65.42 110.737 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -92.22 5.13 51.59 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.341 0.591 . . . . 54.45 109.698 173.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -68.9 120.88 15.5 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.239 -0.891 . . . . 62.33 109.859 174.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.6 mp -72.28 100.69 2.67 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.391 0.615 . . . . 74.41 111.369 -178.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.651 HE22 ' HB2' ' A' ' 11' ' ' LYS . 1.0 OUTLIER -150.61 143.34 24.56 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.246 -1.391 . . . . 71.42 107.246 176.21 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -48.79 104.79 0.1 OUTLIER Glycine 0 C--N 1.331 0.264 0 O-C-N 123.878 0.736 . . . . 62.21 113.418 -174.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.86 -51.83 59.92 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 120.442 0.163 . . . . 72.0 110.853 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -59.18 -45.59 90.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.467 -0.333 . . . . 72.51 110.669 -178.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.448 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 20.0 mmt -60.4 -39.96 89.23 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.065 0.46 . . . . 74.42 110.89 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.651 ' HB2' HE22 ' A' ' 6' ' ' GLN . 36.8 ttpt -69.5 -55.03 11.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.018 -0.537 . . . . 73.02 110.66 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -64.54 -33.35 75.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.706 -0.679 . . . . 73.4 111.933 -174.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.434 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 34.7 t80 -59.08 -51.87 68.2 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 122.999 0.187 . . . . 74.42 110.503 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.814 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 73.6 mm-40 -59.6 -39.25 83.58 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.071 0.462 . . . . 73.11 111.016 179.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.525 ' CB ' HD21 ' A' ' 34' ' ' LEU . 52.8 mm-40 -66.15 -45.47 80.84 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.701 -0.681 . . . . 65.42 110.362 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 54.2 tp -62.98 -44.13 96.88 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.039 -0.528 . . . . 75.54 110.806 178.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.814 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.2 mtpt -50.99 -57.37 8.77 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.096 -0.502 . . . . 71.33 109.707 175.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -55.43 -42.76 74.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.049 -0.978 . . . . 61.12 111.951 -179.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -62.67 -48.26 80.08 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 120.908 0.385 . . . . 65.24 111.353 178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.715 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 32.9 t -72.3 -43.64 64.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 N-CA-C 112.496 0.554 . . . . 75.52 112.496 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 17' ' ' LYS . 8.3 ppt_? -64.45 -15.76 61.26 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 119.954 -0.699 . . . . 75.32 110.848 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -87.25 -72.71 0.5 Allowed 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.096 -0.502 . . . . 74.12 111.082 171.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -116.41 -6.87 11.74 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.32 0.489 . . . . 72.43 112.32 -170.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.715 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 12.1 mpt_? 66.05 13.71 9.23 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.851 0.46 . . . . 74.1 111.209 -176.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.631 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 12.7 ptt180 -161.94 175.61 11.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.586 0.231 . . . . 72.33 110.745 -175.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -104.45 87.83 1.88 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.023 -0.535 . . . . 73.1 110.744 175.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.631 ' HD3' ' O ' ' A' ' 25' ' ' ARG . 8.9 Cg_exo -70.91 -31.36 15.56 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.765 2.31 . . . . 73.42 111.739 -178.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -129.14 112.83 14.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.577 -0.738 . . . . 75.52 109.649 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.5 t -83.44 74.43 10.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.468 0.651 . . . . 73.22 110.586 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 21.2 p -109.81 4.78 22.06 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.754 0.788 . . . . 74.33 109.43 174.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.422 ' OE1' ' HB2' ' A' ' 33' ' ' ASN . 1.3 tm-20 -108.27 120.3 41.98 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.913 -1.04 . . . . 74.22 109.585 -177.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -73.63 -36.8 53.28 Favored Glycine 0 N--CA 1.453 -0.178 0 C-N-CA 120.882 -0.675 . . . . 71.01 113.075 -175.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.422 ' HB2' ' OE1' ' A' ' 31' ' ' GLU . 90.1 m-20 -69.38 -54.62 13.54 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 110.598 -0.149 . . . . 71.41 110.598 -176.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.525 HD21 ' CB ' ' A' ' 15' ' ' GLU . 3.7 mm? -65.52 -32.01 73.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 74.45 110.642 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.19 -38.94 96.45 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 121.012 -0.614 . . . . 64.13 111.756 177.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.78 -31.53 35.76 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.33 -0.938 . . . . 74.22 111.561 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 2.4 t90 -58.79 -53.1 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.348 0.259 . . . . 75.42 111.063 -179.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 10.7 p -62.25 -40.67 96.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.386 -0.37 . . . . 74.12 111.164 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -62.24 -45.58 92.67 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.871 0.367 . . . . 62.01 110.796 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.473 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 27.5 m -66.65 -38.38 86.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.894 -0.594 . . . . 72.23 110.856 179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.595 ' HG3' HD21 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.93 -20.95 60.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.108 -0.497 . . . . 71.31 111.513 -177.169 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -59.78 -43.9 94.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.729 0.299 . . . . 70.14 110.473 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -64.78 -41.54 95.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.318 -0.401 . . . . 75.03 110.097 177.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.555 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 25.3 mmt -57.77 -41.55 82.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.905 -0.589 . . . . 74.43 110.414 -177.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.548 ' HD3' ' C ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -69.84 -49.68 50.12 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.698 -0.683 . . . . 72.11 111.045 -178.604 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -75.88 -22.5 56.08 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 120.881 -0.328 . . . . 73.43 111.324 -173.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.54 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 17.7 tt0 -85.3 -8.72 58.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.041 0.448 . . . . 74.43 110.19 178.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.18 37.62 63.55 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.695 -0.684 . . . . 44.12 112.409 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 14.2 ptmt -131.95 12.45 4.76 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.058 0.392 . . . . 74.31 112.058 -178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.595 HD21 ' HG3' ' A' ' 41' ' ' GLN . 0.9 OUTLIER -63.43 135.32 96.2 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 108.527 -0.916 . . . . 75.02 108.527 176.391 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.763 ' HG2' HH11 ' A' ' 54' ' ' ARG . 20.5 Cg_exo -69.12 138.79 40.75 Favored 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 122.835 2.356 . . . . 65.04 113.109 -177.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.477 ' HA ' ' HG2' ' A' ' 55' ' ' ARG . 89.1 m-20 -69.51 -31.07 69.09 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.842 -1.072 . . . . 74.01 110.136 176.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.62 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 13.1 t70 -71.26 -47.9 54.26 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.531 -0.759 . . . . 74.12 110.144 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.763 HH11 ' HG2' ' A' ' 51' ' ' PRO . 3.2 ttm105 -61.95 -42.73 99.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 64.03 111.12 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.477 ' HG2' ' HA ' ' A' ' 52' ' ' ASN . 18.4 ptp180 -66.44 -31.92 72.97 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 109.745 -0.465 . . . . 72.24 109.745 178.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.16 -37.97 75.33 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 116.255 -0.429 . . . . 44.51 110.216 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.5 mt -59.84 -38.83 83.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 72.43 110.391 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 54' ' ' ARG . 9.9 mp -62.57 -47.9 81.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 75.42 110.655 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.33 -36.56 82.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.814 0.34 . . . . 63.43 110.793 179.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -67.59 -40.01 84.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.094 -0.503 . . . . 74.04 111.671 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.435 HG21 ' HG2' ' A' ' 17' ' ' LYS . 33.6 pt -76.31 -14.03 14.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 C-N-CA 120.579 -0.448 . . . . 35.43 110.877 178.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 110.74 20.16 7.42 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.624 -0.798 . . . . 61.41 113.582 173.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -68.32 130.67 43.58 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.299 0.571 . . . . 71.5 110.603 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.646 HG22 ' H ' ' A' ' 66' ' ' SER . 11.3 p -94.2 139.93 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.879 0 CA-C-N 115.203 -0.908 . . . . 73.02 109.801 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -86.31 16.65 4.26 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.979 0.419 . . . . 74.4 110.652 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.646 ' H ' HG22 ' A' ' 64' ' ' VAL . 21.6 t 66.41 -176.41 0.19 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.333 -0.849 . . . . 72.32 111.002 176.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mp -85.52 137.43 32.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.208 -0.451 . . . . 70.0 109.808 178.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -126.63 154.18 44.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.346 -0.388 . . . . 72.24 110.111 179.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -91.89 92.92 8.56 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.501 0.667 . . . . 73.35 109.223 171.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.4 t60 -100.11 123.98 44.98 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.125 -0.943 . . . . 54.43 109.35 -174.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -66.8 120.37 13.42 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.098 0.475 . . . . 72.33 110.037 -178.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 56.3 p-80 -64.38 132.1 49.12 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.266 -0.879 . . . . 71.13 111.509 -172.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -94.34 -13.18 26.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.638 -0.71 . . . . 72.1 109.159 174.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 78.3 m-70 . . . . . 0 C--O 1.253 1.265 0 CA-C-O 118.413 -0.803 . . . . 62.31 109.001 174.069 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.3 tpp . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 121.188 0.518 . . . . 74.45 110.489 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -93.57 166.57 12.18 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.945 -0.571 . . . . 65.32 110.706 -178.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -144.47 163.97 32.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.921 -0.581 . . . . 74.32 110.008 177.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -124.71 167.19 14.9 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.27 -0.423 . . . . 72.41 110.304 -178.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 mt -70.08 -45.78 66.29 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.778 -0.823 . . . . 64.4 108.778 174.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -167.32 158.44 11.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.397 -1.274 . . . . 60.53 108.622 176.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.3 9.12 48.63 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.252 -0.975 . . . . 64.45 111.596 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.37 -18.97 61.11 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.03 -0.73 . . . . 73.24 109.03 176.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.588 ' HZ2' ' HA ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -50.11 -51.89 39.29 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.384 -0.826 . . . . 64.32 109.897 176.701 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.429 ' SD ' ' N ' ' A' ' 10' ' ' MET . 1.5 mpt? -60.78 -38.15 84.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.992 -0.549 . . . . 75.44 110.762 -177.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.542 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.7 OUTLIER -69.95 -48.45 58.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.79 -0.641 . . . . 75.44 109.939 179.767 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.427 ' ND2' HD21 ' A' ' 33' ' ' ASN . 6.0 m-20 -63.95 -35.83 81.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.996 -0.547 . . . . 64.34 110.673 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -61.62 -54.94 36.2 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 115.737 -0.665 . . . . 71.41 110.135 -177.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -62.57 -29.57 70.68 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.885 -0.326 . . . . 74.34 111.321 -175.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 46.0 mt-10 -65.31 -39.46 92.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.054 0.454 . . . . 72.1 110.312 175.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -87.66 -35.14 18.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.765 -0.652 . . . . 74.43 109.734 -173.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -58.68 -47.73 83.48 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.527 -0.76 . . . . 64.53 110.568 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.3 t -69.97 -26.94 64.34 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.919 -0.582 . . . . 73.32 110.202 178.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.491 ' HE1' ' HA ' ' A' ' 26' ' ' PHE . 37.9 t80 -75.14 -52.26 11.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.175 -0.466 . . . . 73.11 110.547 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.623 ' O ' ' HD2' ' A' ' 24' ' ' ARG . 8.2 p -62.85 -33.79 62.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 73.11 111.984 -176.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -76.17 -20.07 57.87 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 122.005 -0.434 . . . . 75.32 111.001 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.425 ' HD3' ' CE2' ' A' ' 23' ' ' TYR . 62.9 tttm -95.49 -55.32 3.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.647 0.261 . . . . 75.23 111.069 -179.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.425 ' CE2' ' HD3' ' A' ' 22' ' ' LYS . 84.6 m-85 -93.84 -18.9 21.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 111.715 0.265 . . . . 65.04 111.715 -173.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.623 ' HD2' ' O ' ' A' ' 20' ' ' VAL . 30.3 mmm180 64.0 87.07 0.11 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.489 0.662 . . . . 72.3 110.618 -174.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.439 ' H ' HG23 ' A' ' 20' ' ' VAL . 0.1 OUTLIER 68.89 176.19 0.27 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.417 -1.265 . . . . 72.41 111.208 -173.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.653 ' HE1' ' HB3' ' A' ' 34' ' ' LEU . 81.7 m-85 -74.85 143.54 78.31 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.529 -0.759 . . . . 73.44 110.455 175.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -72.82 -29.57 12.33 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.189 1.926 . . . . 65.53 110.563 171.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -174.98 -85.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.93 -1.032 . . . . 73.0 109.372 178.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.8 p 175.01 102.56 0.01 OUTLIER 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.093 -0.958 . . . . 72.42 109.105 178.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.5 t -160.14 2.58 0.08 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.924 0.393 . . . . 75.53 111.276 -176.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 31' ' ' GLU . 1.3 pm0 -95.9 -166.7 1.47 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.292 -0.413 . . . . 62.4 110.45 -178.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -75.61 -118.19 0.12 Allowed Glycine 0 CA--C 1.52 0.403 0 C-N-CA 120.977 -0.63 . . . . 71.34 113.661 -173.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.427 HD21 ' ND2' ' A' ' 12' ' ' ASN . 9.6 t30 -59.84 -34.57 73.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.677 0.275 . . . . 50.44 111.654 -175.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.653 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 87.3 mt -60.81 -37.74 82.99 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.342 -0.39 . . . . 75.31 111.655 -178.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -59.17 -37.74 92.17 Favored Glycine 0 C--N 1.33 0.219 0 C-N-CA 120.983 -0.627 . . . . 74.32 112.014 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -81.68 -38.96 12.73 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.719 -0.753 . . . . 72.3 111.68 176.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -55.17 -42.34 73.05 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 122.779 0.431 . . . . 71.43 111.097 -178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 45.1 t -65.98 -39.41 90.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.034 -0.53 . . . . 62.41 110.553 178.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -70.31 -37.26 74.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 71.33 111.727 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.6 m -68.93 -45.31 71.15 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.134 0.492 . . . . 72.32 110.838 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.73 ' HG3' HD21 ' A' ' 50' ' ' LEU . 2.8 mp0 -75.89 -17.24 59.86 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.085 -0.507 . . . . 63.44 111.588 -177.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.5 tpt85 -59.87 -34.98 73.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.385 0.612 . . . . 72.01 109.863 173.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -74.14 -48.25 30.65 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.134 -0.939 . . . . 74.21 111.086 -179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.721 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.3 mmt -63.25 -29.57 70.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.885 -0.598 . . . . 72.44 110.987 -177.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -61.32 -50.39 73.13 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.836 -0.62 . . . . 74.4 111.172 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.418 ' HB2' ' HE3' ' A' ' 46' ' ' LYS . 20.4 ptmt -77.2 -18.47 57.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.047 0.451 . . . . 64.23 111.038 -175.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -84.75 -13.77 50.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.099 -0.5 . . . . 52.42 110.492 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 70.99 25.49 75.69 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.926 -0.654 . . . . 42.31 112.176 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.459 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.0 ptmt -109.99 -0.95 17.91 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.104 0.478 . . . . 73.42 110.303 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.73 HD21 ' HG3' ' A' ' 41' ' ' GLN . 4.7 mt -62.2 140.79 96.17 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.59 -0.732 . . . . 72.15 109.917 175.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.487 ' HB2' ' HB3' ' A' ' 54' ' ' ARG . 23.9 Cg_exo -65.83 127.27 17.49 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.303 2.002 . . . . 75.12 110.747 172.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -59.04 -33.7 71.07 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.828 -0.623 . . . . 64.13 110.63 178.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.668 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 30.8 m-20 -65.5 -46.71 78.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.199 -0.455 . . . . 73.22 110.023 175.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.588 ' HA ' ' HZ2' ' A' ' 9' ' ' TRP . 31.8 tpt85 -56.42 -33.48 65.87 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.082 0.467 . . . . 74.24 110.869 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.48 ' HA ' ' CZ2' ' A' ' 65' ' ' TRP . 0.2 OUTLIER -73.15 -38.93 66.06 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.337 -0.392 . . . . 73.41 110.843 176.74 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.7 tp -76.34 -40.15 52.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.581 -0.281 . . . . 54.34 111.194 -177.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 63.3 mt -59.31 -33.72 71.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.93 0.395 . . . . 74.54 111.042 -178.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.525 ' HG ' ' NH1' ' A' ' 54' ' ' ARG . 3.2 mm? -71.97 -43.86 64.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 71.34 110.446 176.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -61.42 -34.66 75.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.039 -0.528 . . . . 64.33 110.26 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 57' ' ' LEU . 59.7 mmtt -53.04 -46.94 68.71 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.467 -0.788 . . . . 70.23 110.991 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 7.4 pt -89.87 1.83 7.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.701 -0.681 . . . . 72.32 111.887 -174.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.21 24.44 8.95 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.323 -0.941 . . . . 51.43 113.666 174.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.45 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 34.9 t80 -89.41 101.45 14.13 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.535 -0.913 . . . . 74.14 108.535 173.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.405 HG22 ' H ' ' A' ' 66' ' ' SER . 13.2 p -81.53 128.42 38.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.281 -0.872 . . . . 62.04 111.916 -171.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.487 ' HB2' HD11 ' A' ' 67' ' ' LEU . 58.9 m95 -90.84 -17.54 26.36 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.68 -0.691 . . . . 72.24 109.624 176.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.405 ' H ' HG22 ' A' ' 64' ' ' VAL . 49.2 m 71.63 -77.08 0.06 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.068 -0.969 . . . . 61.04 111.371 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.487 HD11 ' HB2' ' A' ' 65' ' ' TRP . 4.0 mp 58.78 179.73 0.07 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.657 0.742 . . . . 63.22 111.667 -176.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -85.67 130.11 34.65 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.29 -1.004 . . . . 73.31 108.29 166.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -60.88 95.26 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.248 0.547 . . . . 64.42 112.299 -174.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 47.4 m80 -144.69 152.14 39.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.304 -0.862 . . . . 72.54 108.769 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -102.3 109.96 21.78 Favored 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 109.612 -0.514 . . . . 70.15 109.612 175.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -61.94 105.72 0.61 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.343 0.592 . . . . 75.31 110.292 -177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -131.1 138.69 49.64 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.476 -0.784 . . . . 70.44 109.997 -176.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.216 -0.897 . . . . 63.5 109.651 175.944 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.4 mtm . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 121.246 0.546 . . . . 75.11 110.531 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.1 m-20 -117.82 38.16 3.73 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.689 -0.687 . . . . 71.1 110.447 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -71.79 171.92 10.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.773 -0.649 . . . . 70.44 111.342 -178.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -85.3 155.03 21.53 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.12 -0.491 . . . . 74.31 111.026 -179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 6' ' ' GLN . 88.4 mt 69.88 -69.34 0.17 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.656 0.783 . . . . 73.22 113.035 173.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 5' ' ' LEU . 54.6 mt-30 71.87 149.19 0.09 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.742 0.817 . . . . 73.02 111.026 -172.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.76 66.17 3.64 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 121.014 -0.612 . . . . 51.32 111.811 -177.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -75.52 -17.03 60.21 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 121.214 -0.194 . . . . 70.34 110.9 -176.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 4.3 t-105 -63.42 -49.91 71.88 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.14 -0.318 . . . . 72.12 110.14 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.457 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.5 tpt -63.54 -34.92 78.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.101 0.477 . . . . 73.53 110.182 178.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.417 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.2 tmmt? -72.86 -48.21 39.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.744 -0.662 . . . . 73.4 110.556 -178.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -67.55 -39.47 84.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.272 -0.422 . . . . 64.35 111.465 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -62.83 -42.78 99.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.117 -0.233 . . . . 74.33 110.834 -176.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -63.99 -42.75 97.1 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.084 0.469 . . . . 64.04 110.869 178.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.99 -36.61 82.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.688 -0.687 . . . . 71.12 110.57 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 28.6 tp -81.96 -33.84 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 72.34 109.903 -175.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -57.11 -52.05 66.85 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.699 -0.682 . . . . 70.32 109.999 175.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 m -68.51 -31.08 70.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.328 -0.851 . . . . 74.51 110.84 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -70.44 -50.63 36.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.428 -0.351 . . . . 64.21 110.316 -179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.638 ' HA ' ' H ' ' A' ' 25' ' ' ARG . 71.8 t -68.74 -36.88 76.35 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.378 0 CA-C-N 116.634 -0.257 . . . . 63.03 111.078 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -31.61 72.91 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.676 -0.41 . . . . 75.3 110.89 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -94.41 -54.32 3.58 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.934 0.346 . . . . 74.3 111.934 -175.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -97.57 -9.38 27.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.605 0.24 . . . . 72.42 111.417 -175.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.595 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 25.5 mmt180 55.78 79.97 0.15 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.84 -0.618 . . . . 72.51 111.558 -174.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.751 ' HD3' HG12 ' A' ' 64' ' ' VAL . 22.6 mtt180 70.25 171.74 0.31 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.13 -0.941 . . . . 65.31 111.017 175.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.525 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.3 p90 -115.78 85.63 14.65 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 121.235 0.54 . . . . 70.53 110.474 172.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.19 100.72 1.14 Allowed 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.645 2.23 . . . . 74.41 112.108 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.0 mttt 57.95 39.64 26.4 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.757 -0.656 . . . . 64.54 110.533 177.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.525 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 37.0 m -93.35 173.75 7.55 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.649 -0.705 . . . . 51.45 111.391 -176.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p -120.45 71.16 0.91 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.606 0.717 . . . . 52.12 109.788 178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -94.61 177.41 5.93 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.023 -0.99 . . . . 72.33 111.106 -175.127 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -90.37 -114.04 1.63 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.109 -0.567 . . . . 44.35 113.566 -174.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -55.33 -41.32 72.3 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.848 0.356 . . . . 74.45 111.406 -175.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.28 -33.47 73.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.533 . . . . 75.24 111.217 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.455 ' N ' ' HG2' ' A' ' 31' ' ' GLU . . . -61.29 -49.79 73.92 Favored Glycine 0 CA--C 1.5 -0.869 0 C-N-CA 120.745 -0.74 . . . . 64.55 111.324 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.18 -31.24 71.81 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.561 -0.828 . . . . 43.05 111.139 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.648 ' HH2' HD21 ' A' ' 58' ' ' LEU . 7.7 t90 -56.17 -56.13 24.64 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.25 0.547 . . . . 64.41 109.954 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.3 t -71.19 -44.98 64.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.511 -0.768 . . . . 64.22 111.477 -177.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -57.68 -28.63 63.96 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.812 0.339 . . . . 65.15 111.635 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 88.1 m -84.38 -51.15 7.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.17 0.509 . . . . 71.02 111.162 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.522 ' HB3' HD11 ' A' ' 50' ' ' LEU . 61.1 mt-30 -76.6 -24.22 53.46 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.946 0.721 . . . . 74.35 112.946 -170.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.565 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 13.2 ttt180 -55.83 -42.53 75.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.474 0.654 . . . . 70.24 109.404 173.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -76.11 -32.13 59.03 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.577 -0.738 . . . . 61.12 110.075 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 14.8 mmt -60.53 -45.76 92.66 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.398 -0.364 . . . . 65.4 111.521 176.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.605 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -65.58 -33.15 75.23 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.824 -0.35 . . . . 73.32 110.766 -177.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.469 ' HB2' HH11 ' A' ' 45' ' ' ARG . 5.2 tmmm? -73.87 -36.66 64.85 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.471 0.653 . . . . 71.23 109.53 176.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -73.56 -14.98 61.3 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.338 -0.846 . . . . 74.05 110.653 -178.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.624 ' C ' ' HE3' ' A' ' 49' ' ' LYS . . . 82.26 21.75 60.1 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.071 -0.585 . . . . 71.44 111.945 -178.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.624 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 0.1 OUTLIER -95.09 -14.23 24.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.403 0.621 . . . . 32.32 110.535 -177.38 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.73 HD23 ' HD2' ' A' ' 51' ' ' PRO . 3.5 mt -93.6 141.74 24.25 Favored Pre-proline 0 C--N 1.315 -0.902 0 CA-C-N 115.315 -0.857 . . . . 64.41 110.248 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.73 ' HD2' HD23 ' A' ' 50' ' ' LEU . 83.7 Cg_endo -85.16 161.01 11.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.634 2.223 . . . . 65.44 111.736 170.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -71.35 -24.15 62.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.894 -0.594 . . . . 74.04 110.064 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.12 -51.75 66.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.734 -0.666 . . . . 74.24 111.192 -177.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.4 ttm180 -67.87 -49.19 63.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.085 0.469 . . . . 74.21 110.376 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.52 ' NH1' ' HB2' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -50.41 -36.59 33.67 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.388 -0.824 . . . . 73.13 111.324 177.532 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.3 tp -68.35 -42.96 78.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 75.3 111.096 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.0 mp -62.35 -34.32 76.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.806 0.336 . . . . 64.21 110.869 178.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.648 HD21 ' HH2' ' A' ' 37' ' ' TRP . 4.4 mm? -65.65 -38.95 90.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.372 0.606 . . . . 54.35 110.473 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.52 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 12.4 t70 -64.94 -38.1 89.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.89 -0.595 . . . . 62.24 110.332 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -63.51 -41.7 98.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.775 -0.648 . . . . 74.32 111.969 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.453 HD11 HD13 ' A' ' 58' ' ' LEU . 35.3 pt -76.27 -16.22 15.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 C-N-CA 120.563 -0.455 . . . . 63.01 110.906 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.67 33.6 3.28 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.731 -0.747 . . . . 45.54 112.984 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.429 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 48.0 t80 -93.79 133.78 36.81 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.072 0.463 . . . . 64.04 110.51 178.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.751 HG12 ' HD3' ' A' ' 25' ' ' ARG . 14.3 p -105.09 140.06 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-N 115.782 -0.644 . . . . 61.54 109.87 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -100.29 1.54 41.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.713 -0.222 . . . . 74.32 111.075 -177.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.721 ' H ' HG22 ' A' ' 64' ' ' VAL . 33.4 t 72.25 154.15 0.14 Allowed 'General case' 0 N--CA 1.465 0.321 0 O-C-N 124.022 0.827 . . . . 71.11 111.614 177.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.543 HD12 ' HB3' ' A' ' 70' ' ' HIS . 0.2 OUTLIER -80.3 -25.97 39.09 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.817 -0.809 . . . . 75.12 108.817 175.836 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 69.83 -71.25 0.13 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 114.778 -1.101 . . . . 74.11 112.85 174.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.443 ' O ' ' HB2' ' A' ' 70' ' ' HIS . 41.1 m80 -123.34 80.94 1.83 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.884 0.373 . . . . 75.12 111.731 -170.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.543 ' HB3' HD12 ' A' ' 67' ' ' LEU . 3.6 t-160 175.35 89.03 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.098 -0.955 . . . . 75.4 108.914 175.118 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -59.23 123.22 15.99 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.392 0.615 . . . . 75.33 111.142 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 62.4 m80 -80.72 142.64 33.65 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.477 -0.783 . . . . 65.1 109.307 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.7 p-80 -120.4 149.17 42.78 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.833 -0.347 . . . . 73.34 110.858 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 60.2 m80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.351 -0.833 . . . . 75.12 109.703 179.439 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.6 mtt . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 120.683 0.278 . . . . 73.41 111.092 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -90.47 -24.86 20.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.629 0.252 . . . . 74.24 111.521 -177.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -103.09 108.57 19.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.031 0.443 . . . . 75.2 111.037 -178.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -120.38 -53.82 2.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.595 -0.729 . . . . 72.33 109.534 175.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 85.7 mt 62.97 23.64 14.12 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.085 -0.961 . . . . 70.34 111.101 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -104.7 160.56 14.87 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.86 -0.609 . . . . 74.24 110.375 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.74 54.58 4.13 Favored Glycine 0 CA--C 1.517 0.192 0 C-N-CA 121.126 -0.559 . . . . 43.32 112.812 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -94.75 -33.29 12.95 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.061 -0.348 . . . . 71.15 110.061 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.499 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 23.8 t-105 -61.88 -44.72 96.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.042 -0.526 . . . . 70.12 111.866 -174.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.513 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 12.0 mmt -54.35 -37.82 65.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.088 0.47 . . . . 53.41 111.131 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -79.36 -49.09 12.94 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.965 -0.561 . . . . 71.1 110.243 175.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -52.71 -47.25 67.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.924 -1.035 . . . . 63.33 111.464 -175.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -54.72 -51.94 64.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.861 -0.608 . . . . 70.14 110.934 179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -66.72 -36.5 82.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 72.31 111.687 -178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.99 -36.53 69.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.178 -0.464 . . . . 74.41 110.631 -177.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.455 ' O ' HD23 ' A' ' 16' ' ' LEU . 4.2 tt -77.36 -35.69 54.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.188 -1.041 . . . . 75.44 108.188 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -55.65 -42.09 74.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.785 -1.098 . . . . 63.04 110.395 174.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -74.85 -29.95 61.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.631 -0.713 . . . . 72.35 110.925 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -75.4 -46.18 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.514 -0.312 . . . . 73.35 111.435 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.567 HG11 ' HB ' ' A' ' 61' ' ' ILE . 8.1 p -65.25 -34.15 68.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.573 -0.285 . . . . 72.05 111.205 -179.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -78.86 -16.42 57.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.137 0.494 . . . . 73.45 110.147 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -77.8 -67.43 0.73 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.805 -0.634 . . . . 74.15 110.986 -176.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -116.86 12.98 14.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.621 0.23 . . . . 73.45 111.621 -176.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.51 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 16.1 mmt180 62.31 88.26 0.09 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.722 0.639 . . . . 72.41 110.733 -177.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.475 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 2.2 tmt_? 70.57 166.0 0.29 Allowed 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.581 -0.736 . . . . 55.15 109.317 -177.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.491 ' HB2' ' O ' ' A' ' 29' ' ' SER . 8.8 p90 -113.52 86.83 10.74 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 121.151 0.501 . . . . 74.33 111.3 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -89.79 -4.62 5.4 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 123.117 2.545 . . . . 65.23 112.603 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -137.3 -45.96 0.56 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.044 -0.525 . . . . 70.31 109.811 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.491 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 5.3 m -69.67 141.32 53.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.42 -0.809 . . . . 72.32 109.844 175.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.3 p -122.29 -37.9 2.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.66 0.267 . . . . 70.15 111.17 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 67.75 1.36 2.61 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 122.068 0.937 . . . . 63.41 110.977 176.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 78.84 -70.5 2.72 Favored Glycine 0 C--N 1.307 -1.073 0 CA-C-N 115.187 -0.915 . . . . 33.21 112.273 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -70.02 -48.81 56.53 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.525 0.195 . . . . 72.34 111.525 -176.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.1 mt -58.63 -42.56 88.54 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.738 0.304 . . . . 74.13 111.066 178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -57.81 -42.99 94.84 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.078 -0.582 . . . . 74.34 111.956 177.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.79 -39.8 76.09 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.848 -0.691 . . . . 65.13 111.528 177.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -54.64 -48.97 71.63 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.483 -0.562 . . . . 73.43 109.483 176.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 49.3 t -64.07 -51.42 64.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.134 -0.939 . . . . 74.44 110.877 178.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -52.72 -44.71 66.56 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.363 0.505 . . . . 52.33 112.363 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 46.0 m -70.9 -45.23 64.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.158 0.504 . . . . 73.14 111.264 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.45 ' HG2' HD21 ' A' ' 50' ' ' LEU . 33.9 mt-30 -86.44 -12.58 48.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.764 1.024 . . . . 72.44 113.764 -171.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -73.74 -4.73 36.37 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.297 0.57 . . . . 72.04 109.952 174.026 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.743 ' HD3' ' HG3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -92.67 -47.78 6.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.504 -0.771 . . . . 63.31 108.982 172.299 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.754 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 12.5 mmt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.573 -0.739 . . . . 75.21 111.231 -175.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.649 ' HG3' ' N ' ' A' ' 46' ' ' LYS . 14.1 ptt180 -52.37 -49.34 64.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.991 -0.55 . . . . 74.45 111.519 -178.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.649 ' N ' ' HG3' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -82.2 -43.7 17.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.867 -0.606 . . . . 71.33 109.854 -175.513 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.743 ' HG3' ' HD3' ' A' ' 43' ' ' LYS . 10.9 mm-40 -60.91 -18.0 54.11 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.378 -0.828 . . . . 73.31 111.688 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.24 36.24 24.7 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.924 -0.655 . . . . 75.15 111.522 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.762 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.8 mmpt? -108.65 -10.25 15.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 71.5 110.066 -177.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.661 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 11.0 mt -75.38 142.6 75.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 115.627 -0.715 . . . . 74.11 111.226 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -70.92 137.92 33.06 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.745 2.296 . . . . 74.14 110.947 172.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.585 ' HA ' ' CG ' ' A' ' 55' ' ' ARG . 74.3 m-20 -63.82 -22.49 66.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.613 -0.721 . . . . 75.21 111.965 -177.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.764 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 20.2 m-20 -64.27 -52.74 57.18 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.445 -0.576 . . . . 64.33 109.445 179.179 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -63.8 -47.12 82.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.662 -0.699 . . . . 63.34 111.295 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.585 ' CG ' ' HA ' ' A' ' 52' ' ' ASN . 7.7 ppt_? -65.51 -23.65 66.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.003 0.43 . . . . 73.22 110.539 -175.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.6 tp -82.35 -37.43 25.68 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.816 -0.438 . . . . 62.2 109.816 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.764 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 41.4 mt -66.39 -43.75 84.98 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.377 -0.374 . . . . 73.2 110.538 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.407 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 94.7 mt -64.32 -44.07 92.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.128 -0.487 . . . . 54.23 110.621 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -68.88 -20.39 64.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.17 0.51 . . . . 75.11 110.353 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? -79.55 -39.73 31.17 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.802 -0.635 . . . . 75.24 110.767 177.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.567 ' HB ' HG11 ' A' ' 20' ' ' VAL . 19.4 pt -80.99 -9.8 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.662 0.268 . . . . 72.03 111.366 -179.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.76 6.44 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.624 -0.798 . . . . 43.05 112.816 175.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.407 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 85.6 t80 -84.07 120.48 26.2 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.09 0.471 . . . . 71.5 110.309 179.084 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 15.0 p -77.42 131.14 35.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.34 -0.845 . . . . 62.41 110.068 178.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.495 ' CZ2' ' HA ' ' A' ' 55' ' ' ARG . 94.6 m95 -90.2 -19.35 24.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.196 -0.456 . . . . 74.41 112.138 -173.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.7 m 62.81 26.95 15.85 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 122.065 0.936 . . . . 74.51 109.031 -172.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 47.3 tp -138.8 159.22 42.64 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.359 -1.292 . . . . 73.1 108.006 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -60.22 100.84 0.1 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.103 0.478 . . . . 72.4 111.522 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -77.82 79.59 4.3 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.681 -0.859 . . . . 64.13 108.681 174.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.5 t-160 -131.67 -64.42 0.79 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.657 -0.701 . . . . 71.13 110.533 -175.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.4 t-80 68.57 150.11 0.07 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 124.071 0.857 . . . . 74.43 109.593 -173.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -74.24 81.44 1.83 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.49 0.662 . . . . 73.24 111.058 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -98.7 -15.32 19.42 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.371 -0.831 . . . . 62.13 108.815 174.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 61.6 t60 . . . . . 0 C--O 1.244 0.792 0 CA-C-N 114.76 -1.109 . . . . 71.24 109.089 178.818 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.879 -0.415 . . . . 73.05 109.879 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -110.03 103.94 12.75 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.806 -0.442 . . . . 72.44 109.806 176.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -74.08 115.99 14.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.235 0.541 . . . . 74.11 110.844 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -126.97 -157.75 0.83 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.66 -0.7 . . . . 53.51 109.149 179.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.7 tt -89.58 77.53 7.19 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.92 -0.77 . . . . 72.54 108.92 175.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.504 ' H ' ' NE2' ' A' ' 6' ' ' GLN . 0.6 OUTLIER -116.19 131.34 56.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.15 0.5 . . . . 61.01 110.218 177.787 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -84.34 50.84 4.47 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.746 -0.661 . . . . 74.31 112.551 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.73 -14.29 61.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 110.131 -0.322 . . . . 43.22 110.131 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.477 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 11.7 t-105 -57.52 -46.46 83.79 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 121.298 0.57 . . . . 60.03 109.981 173.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.542 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 15.2 mmt -66.1 -23.95 66.6 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.967 -0.561 . . . . 64.14 110.791 177.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.46 -51.49 9.28 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.065 -0.516 . . . . 74.11 110.379 179.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.8 p30 -78.1 -25.22 47.44 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 112.579 0.585 . . . . 71.33 112.579 -175.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -62.46 -52.51 63.22 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 121.096 -0.242 . . . . 73.24 110.727 177.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 10' ' ' MET . 8.4 pt-20 -68.45 -25.26 64.91 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.349 0.595 . . . . 74.45 110.157 177.397 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' O ' HD11 ' A' ' 34' ' ' LEU . 12.2 tt0 -68.66 -31.83 71.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.363 -0.835 . . . . 70.35 109.844 178.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.559 HD22 ' CZ3' ' A' ' 37' ' ' TRP . 41.2 tp -88.81 -39.27 14.0 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-O 121.312 0.577 . . . . 75.12 109.571 178.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.472 ' HG3' HG21 ' A' ' 61' ' ' ILE . 59.2 tttm -53.29 -51.85 60.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.888 -1.051 . . . . 65.44 111.284 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.6 p -61.14 -33.53 73.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.68 -0.691 . . . . 43.41 111.463 -179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.555 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 14.5 t80 -75.38 -49.67 18.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.847 0.356 . . . . 75.13 110.389 -178.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 53.9 t -63.17 -36.18 74.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.177 -0.465 . . . . 63.42 110.666 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttt180 -53.83 -30.39 45.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.07 -0.514 . . . . 72.54 110.954 178.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -92.33 -56.03 3.19 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.879 -0.6 . . . . 73.14 112.042 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.94 -29.15 11.6 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 120.874 0.369 . . . . 65.54 111.113 -171.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.58 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.1 OUTLIER 62.3 104.28 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.218 -0.901 . . . . 71.13 110.192 -164.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.5 mmt180 77.79 153.3 0.14 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 114.572 -1.195 . . . . 73.41 111.625 -177.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.555 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 6.5 p90 -132.09 88.38 41.04 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 114.627 -1.169 . . . . 55.42 109.054 177.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.34 70.89 0.43 Allowed 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 122.82 2.347 . . . . 73.34 112.278 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.1 mttm 62.84 38.51 11.48 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.582 -0.735 . . . . 70.03 110.165 179.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.1 m -57.75 -74.93 0.05 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.263 -0.881 . . . . 72.42 111.935 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 17.5 p -112.48 -35.66 5.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.006 0.432 . . . . 73.12 110.525 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.972 ' HA ' ' HA3' ' A' ' 35' ' ' GLY . 41.3 mt-10 57.59 34.33 24.41 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.434 -0.803 . . . . 72.55 111.995 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -82.01 -104.86 0.4 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.427 -0.892 . . . . 72.44 111.322 173.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.7 m-20 -62.88 -55.92 21.85 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.329 0.585 . . . . 71.33 110.948 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.414 HD13 HD12 ' A' ' 16' ' ' LEU . 98.2 mt -74.37 -32.08 62.62 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.37 -0.832 . . . . 71.01 111.104 -174.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.972 ' HA3' ' HA ' ' A' ' 31' ' ' GLU . . . -61.19 -43.57 99.23 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.335 -0.936 . . . . 64.01 111.218 177.032 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.37 -30.73 66.61 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 110.986 -0.845 . . . . 50.31 110.986 178.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.719 ' O ' HG22 ' A' ' 40' ' ' THR . 2.1 t90 -63.79 -46.44 85.17 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 109.441 -0.577 . . . . 74.43 109.441 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.486 ' HB2' ' HZ ' ' A' ' 26' ' ' PHE . 42.3 t -60.1 -45.42 93.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.089 -0.505 . . . . 73.54 110.324 176.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.423 ' O ' ' HB3' ' A' ' 42' ' ' ARG . 74.4 m-70 -61.52 -32.43 72.48 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.277 -0.419 . . . . 65.51 111.988 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.719 HG22 ' O ' ' A' ' 37' ' ' TRP . 1.3 t -71.05 -39.28 72.36 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 120.438 -0.505 . . . . 52.23 110.049 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -73.18 -27.57 61.72 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 120.859 0.361 . . . . 51.01 110.646 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 39' ' ' HIS . 21.3 tpt180 -54.98 -44.23 74.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.67 -0.695 . . . . 70.21 109.435 171.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 40' ' ' THR . 20.7 mtpp -71.79 -57.03 4.7 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 115.09 -0.959 . . . . 70.24 110.406 177.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.712 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.0 mmt -54.63 -33.99 61.42 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.808 -0.633 . . . . 71.05 111.973 -173.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.861 ' HB2' HD12 ' A' ' 50' ' ' LEU . 23.9 tpt180 -74.14 -47.98 32.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.738 0.304 . . . . 65.14 110.334 177.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.479 ' HB3' ' HE2' ' A' ' 46' ' ' LYS . 5.1 tmmm? -64.99 -29.95 70.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.173 0.511 . . . . 72.54 110.162 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -79.23 -20.72 47.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.843 -0.617 . . . . 74.0 110.647 176.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 77.34 49.76 7.17 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.684 -0.689 . . . . 43.21 113.165 176.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.63 ' HD2' ' SD ' ' A' ' 44' ' ' MET . 0.1 OUTLIER -143.32 11.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.951 0.405 . . . . 61.31 111.915 177.678 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.861 HD12 ' HB2' ' A' ' 45' ' ' ARG . 5.7 mt -69.78 140.97 89.46 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.06 -0.518 . . . . 71.35 110.329 176.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.504 ' HD2' ' CD2' ' A' ' 50' ' ' LEU . 76.8 Cg_endo -80.63 144.92 16.0 Favored 'Trans proline' 0 C--O 1.239 0.535 0 C-N-CA 122.805 2.336 . . . . 73.44 113.047 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -65.5 -44.72 86.16 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.846 -1.07 . . . . 70.54 111.749 -179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.701 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 8.6 m-20 -54.78 -52.5 62.4 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.313 -0.403 . . . . 74.55 111.528 -175.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.558 HH11 ' HB3' ' A' ' 54' ' ' ARG . 3.1 ttp-105 -57.01 -46.0 82.64 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 65.31 110.697 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.72 -50.15 69.02 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.041 -0.981 . . . . 73.02 109.968 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.1 tp -67.64 -34.38 76.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 55.42 111.618 -176.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 78.4 mt -62.61 -31.86 72.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 75.3 110.874 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 63.9 mt -71.67 -36.98 70.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.065 0.46 . . . . 75.43 110.443 178.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.22 -33.93 72.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.211 -0.449 . . . . 72.31 110.545 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -69.42 -31.78 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 71.02 111.881 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 17' ' ' LYS . 38.9 pt -86.81 -7.13 10.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.653 -0.419 . . . . 74.21 110.903 179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 99.21 22.81 12.21 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.659 -0.782 . . . . 71.15 112.77 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -82.9 108.12 16.0 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.246 0.546 . . . . 74.53 110.104 178.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 11.1 p -78.89 142.6 13.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.48 -0.782 . . . . 73.24 110.641 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.494 ' HA ' HH21 ' A' ' 25' ' ' ARG . 94.6 m95 -98.28 -36.5 9.99 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.43 -0.35 . . . . 74.21 110.288 179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.7 t 64.29 -166.03 0.23 Allowed 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.841 0.713 . . . . 53.11 110.529 178.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.3 mp -119.59 148.04 43.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.566 -0.288 . . . . 70.42 110.495 -177.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.495 ' HG2' ' N ' ' A' ' 69' ' ' HIS . 29.4 tt0 -153.9 157.98 40.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.106 -0.497 . . . . 73.41 110.28 -179.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.495 ' N ' ' HG2' ' A' ' 68' ' ' GLU . 28.8 m170 68.08 20.0 9.12 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.125 0.57 . . . . 74.24 111.878 173.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 42.4 m170 -118.87 155.07 31.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.56 -0.533 . . . . 54.2 109.56 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -174.1 -51.84 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.933 -0.766 . . . . 64.14 108.933 -179.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -172.91 -39.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.451 -0.795 . . . . 74.42 109.627 173.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -84.93 166.68 16.6 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.658 -0.497 . . . . 73.25 109.658 174.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 11.6 p80 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.394 -0.812 . . . . 75.44 110.284 -179.765 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 110.107 -0.331 . . . . 73.05 110.107 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -128.39 112.47 14.45 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.178 -0.464 . . . . 73.05 110.063 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -116.84 14.54 15.22 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.97 0.414 . . . . 75.11 111.035 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -98.29 -19.86 17.56 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.85 -0.796 . . . . 74.42 108.85 172.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.1 mt -133.94 124.28 26.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.656 -1.156 . . . . 61.21 108.928 174.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -74.41 -50.03 20.12 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.943 0.401 . . . . 55.43 110.142 -176.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -97.84 39.45 2.77 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.783 -0.722 . . . . 61.22 112.004 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.475 ' OE2' ' HB3' ' A' ' 12' ' ' ASN . 4.2 tm-20 -66.47 -39.21 88.68 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.881 -0.414 . . . . 75.44 109.881 -179.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.649 ' HZ2' HD12 ' A' ' 57' ' ' LEU . 18.5 t-105 -51.82 -57.03 10.5 Favored 'General case' 0 C--N 1.334 -0.105 0 O-C-N 123.513 0.508 . . . . 75.04 111.278 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 45.2 ttm -58.25 -35.02 71.12 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.748 0.309 . . . . 73.2 110.875 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' A' ' 11' ' ' LYS . 1.6 tmmt? -69.36 -55.47 10.29 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 116.187 -0.46 . . . . 74.04 110.921 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.506 HD21 ' HA ' ' A' ' 9' ' ' TRP . 11.8 p30 -66.09 -32.69 74.29 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 120.513 -0.475 . . . . 75.23 111.206 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.592 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 36.3 t80 -63.71 -45.75 88.56 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.279 . . . . 74.33 110.672 -179.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.496 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 38.7 mm-40 -58.97 -35.1 72.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.812 0.339 . . . . 71.25 111.287 178.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -75.45 -40.03 58.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.257 0.551 . . . . 72.54 110.041 177.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.441 HD13 HD22 ' A' ' 34' ' ' LEU . 47.0 tp -64.5 -40.25 95.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.281 -0.872 . . . . 73.33 111.597 -178.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 13' ' ' TYR . 55.2 mtpt -51.32 -57.71 8.16 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.348 0.594 . . . . 65.51 110.388 177.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.1 m -63.06 -37.05 85.63 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.915 -1.039 . . . . 54.42 111.336 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.534 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 11.2 t80 -65.73 -47.16 76.27 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.932 0.396 . . . . 74.34 110.621 -179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.52 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 40.2 t -67.76 -34.37 67.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.207 -0.451 . . . . 72.42 111.193 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -69.76 -39.83 76.48 Favored 'General case' 0 C--N 1.321 -0.674 0 C-N-CA 120.928 -0.309 . . . . 74.52 110.367 178.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -74.67 -52.59 11.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.341 -0.391 . . . . 73.15 111.406 -174.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -96.31 -20.82 18.22 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.017 0.377 . . . . 74.35 112.017 -174.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.624 ' O ' ' HG2' ' A' ' 25' ' ' ARG . 18.8 mmt180 63.47 92.99 0.06 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.607 0.567 . . . . 72.24 110.158 -169.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 15.1 ptt-85 61.18 169.84 0.1 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 114.542 -1.208 . . . . 74.01 111.298 -176.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.808 ' HB2' ' HB2' ' A' ' 29' ' ' SER . 1.8 p90 -141.04 86.65 11.34 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-O 121.517 0.675 . . . . 74.24 110.754 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_exo -71.23 -39.51 3.86 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 123.116 2.544 . . . . 74.45 113.02 -175.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -115.71 5.53 14.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.805 0.336 . . . . 71.21 111.303 -174.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.808 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 13.8 m -87.82 114.87 24.84 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.094 0.473 . . . . 75.12 110.747 -177.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.564 ' HA ' ' CA ' ' A' ' 35' ' ' GLY . 13.1 t -119.09 23.52 11.31 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.518 0.675 . . . . 70.13 110.186 -179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -72.81 139.0 46.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.307 -0.86 . . . . 73.42 111.808 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 57.54 -152.44 26.33 Favored Glycine 0 N--CA 1.45 -0.373 0 CA-C-N 115.388 -0.823 . . . . 74.05 113.572 174.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.464 HD21 ' HB2' ' A' ' 12' ' ' ASN . 2.4 p-10 -69.81 -27.84 65.22 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.82 -0.19 . . . . 71.21 110.769 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.441 HD22 HD13 ' A' ' 16' ' ' LEU . 81.1 mt -61.4 -38.93 88.85 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.816 0.341 . . . . 61.21 110.914 -178.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.564 ' CA ' ' HA ' ' A' ' 30' ' ' THR . . . -58.72 -42.97 96.63 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.895 -0.669 . . . . 72.04 112.358 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -82.21 -26.71 47.16 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.275 -0.964 . . . . 53.24 111.293 177.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.414 ' HB2' ' O ' ' A' ' 33' ' ' ASN . 5.2 t90 -56.58 -56.43 21.47 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 122.951 0.5 . . . . 72.31 110.584 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 26.7 p -65.09 -37.06 86.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.839 -0.619 . . . . 72.34 111.579 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.448 ' O ' ' HB2' ' A' ' 42' ' ' ARG . 24.1 m80 -73.62 -40.46 63.78 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.026 -0.534 . . . . 74.45 111.908 -176.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.527 ' HA ' ' HE2' ' A' ' 43' ' ' LYS . 95.9 m -63.65 -38.07 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.006 0.431 . . . . 74.53 110.966 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.971 ' HG2' HD21 ' A' ' 50' ' ' LEU . 7.9 mt-30 -76.55 -9.62 58.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.237 -0.438 . . . . 64.14 112.089 -178.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 39' ' ' HIS . 5.1 mpt_? -62.41 -38.98 91.77 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.658 -0.497 . . . . 75.43 109.658 171.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.527 ' HE2' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -72.37 -37.37 68.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.635 -0.711 . . . . 73.52 110.34 179.189 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.481 ' CB ' ' HG ' ' A' ' 50' ' ' LEU . 16.9 mmt -71.32 -34.81 70.9 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 52.0 110.635 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.2 ttt-85 -63.89 -45.27 90.12 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.45 0.643 . . . . 63.22 109.635 173.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.6 tttp -61.93 -49.09 77.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.541 -1.209 . . . . 61.12 111.146 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -63.77 -31.07 72.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.703 -0.68 . . . . 60.44 110.352 177.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.89 32.24 15.41 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.745 -0.661 . . . . 71.13 112.712 176.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 49' ' ' LYS . 12.5 ptmt -121.98 7.16 9.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.792 0.329 . . . . 61.24 111.025 -178.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.971 HD21 ' HG2' ' A' ' 41' ' ' GLN . 4.6 mt -60.02 138.81 90.99 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.825 -0.625 . . . . 72.14 110.656 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 32.3 Cg_exo -61.08 131.86 38.94 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.183 2.588 . . . . 74.32 112.965 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.411 ' O ' ' HB3' ' A' ' 55' ' ' ARG . 8.0 t30 -72.18 -39.66 68.51 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.355 -0.838 . . . . 64.31 111.374 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.691 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 50.7 m-20 -58.29 -53.83 53.83 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.148 0.499 . . . . 64.14 110.069 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.543 ' O ' ' HG ' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -59.44 -39.82 84.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.254 -0.884 . . . . 75.03 110.738 176.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.424 ' HA ' ' HZ2' ' A' ' 65' ' ' TRP . 11.4 ttt180 -55.85 -50.32 70.92 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.931 -0.577 . . . . 71.21 110.6 177.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.9 tp -67.81 -36.24 80.06 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.467 -0.788 . . . . 75.23 110.548 -176.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.691 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 59.4 mt -62.19 -33.59 74.84 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.259 -0.428 . . . . 75.01 110.822 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 54' ' ' ARG . 56.8 mt -71.47 -41.35 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.138 0.494 . . . . 73.3 110.377 178.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.96 -32.01 73.53 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.132 -0.485 . . . . 72.41 110.257 177.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.9 mmtt -58.87 -47.64 84.2 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.879 -0.601 . . . . 65.12 111.668 176.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.57 HG21 ' HG2' ' A' ' 17' ' ' LYS . 30.2 pt -77.71 -9.72 12.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.839 0.352 . . . . 74.43 111.488 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 107.25 14.09 19.39 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.537 -0.839 . . . . 65.5 113.53 174.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -72.57 124.19 24.74 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.834 -0.432 . . . . 74.43 109.834 177.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.651 HG22 ' H ' ' A' ' 66' ' ' SER . 14.4 p -86.09 134.14 28.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.929 -0.578 . . . . 74.41 110.831 -176.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.424 ' HZ2' ' HA ' ' A' ' 55' ' ' ARG . 94.6 m95 -92.24 20.32 6.13 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.975 -0.557 . . . . 73.21 111.263 -178.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.651 ' H ' HG22 ' A' ' 64' ' ' VAL . 14.4 m 71.26 123.87 0.03 OUTLIER 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.223 -0.899 . . . . 62.33 112.135 174.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.4 mp -73.4 -173.73 1.47 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.88 -0.6 . . . . 75.41 109.484 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 59.06 75.01 0.42 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 108.341 -0.985 . . . . 72.04 108.341 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -118.96 117.78 29.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.037 -0.983 . . . . 71.42 110.675 -170.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -107.31 158.59 17.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.641 -0.254 . . . . 74.31 110.873 179.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 27.9 m80 -103.67 143.52 32.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.131 -0.486 . . . . 75.01 111.066 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -171.15 137.54 1.16 Allowed 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.03 -0.729 . . . . 71.51 109.03 178.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -156.8 76.37 0.87 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.298 0.571 . . . . 75.35 111.95 -177.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.402 -0.809 . . . . 55.54 109.427 175.819 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.2 mtt . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 120.548 0.214 . . . . 64.21 110.823 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -67.88 -42.52 81.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.085 0.469 . . . . 74.4 110.184 174.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -138.19 144.47 40.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.735 -0.666 . . . . 75.2 109.881 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -117.68 -19.74 9.21 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.981 0.42 . . . . 74.32 110.463 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.8 mt -113.73 153.54 28.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.079 -0.51 . . . . 53.31 110.237 178.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 63.19 50.78 2.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.59 -0.732 . . . . 70.32 110.792 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -71.98 71.75 0.93 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.044 -0.598 . . . . 64.51 111.811 174.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -57.5 -26.21 60.97 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 122.973 0.509 . . . . 64.22 111.377 -176.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.485 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 2.9 t-105 -57.45 -42.2 82.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.113 -0.494 . . . . 73.21 111.057 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.459 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.9 tpt -59.18 -41.03 87.5 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.25 0.548 . . . . 32.21 110.572 -179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -70.27 -57.86 4.4 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.257 -0.883 . . . . 73.13 110.791 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -54.38 -32.0 56.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.989 -1.005 . . . . 71.34 111.241 -179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.659 ' HE1' ' HB3' ' A' ' 57' ' ' LEU . 63.8 t80 -58.41 -55.27 37.13 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.23 -0.441 . . . . 61.24 110.655 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.788 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 68.2 mm-40 -64.5 -36.73 85.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.848 0.356 . . . . 64.13 111.204 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -65.15 -45.73 83.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.151 -0.477 . . . . 72.34 110.09 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.6 tp -65.22 -40.08 93.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.864 -0.607 . . . . 64.41 110.95 -178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.788 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 56.7 mtpt -52.95 -58.85 5.58 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 120.931 0.396 . . . . 62.54 110.438 177.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.6 m -62.36 -36.34 81.96 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.227 -0.897 . . . . 74.24 111.414 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.672 ' HE2' ' HA ' ' A' ' 26' ' ' PHE . 18.9 t80 -63.16 -48.38 78.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 74.34 110.461 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.573 ' HA ' ' H ' ' A' ' 25' ' ' ARG . 64.6 t -71.8 -38.69 66.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.985 0.421 . . . . 52.1 110.562 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 46.0 ttt180 -55.82 -46.4 78.11 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.698 -0.683 . . . . 70.41 111.632 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -95.19 -48.84 5.76 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.306 0.484 . . . . 71.3 112.306 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -100.32 -15.93 17.85 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.026 0.38 . . . . 63.54 112.026 -170.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.536 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 6.8 mmt180 65.08 95.28 0.05 Allowed 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.678 0.611 . . . . 73.35 111.519 -175.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.573 ' H ' ' HA ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER 50.86 -172.74 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.657 1.183 . . . . 65.3 112.577 178.265 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.672 ' HA ' ' HE2' ' A' ' 19' ' ' PHE . 59.8 m-85 -73.11 143.78 84.08 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.08 -0.509 . . . . 55.21 110.78 -179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.78 -46.85 12.46 Favored 'Trans proline' 0 C--O 1.235 0.364 0 C-N-CA 122.578 2.186 . . . . 73.02 111.221 174.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -161.12 38.96 0.15 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.914 -0.773 . . . . 72.0 108.914 174.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.1 m 68.18 -177.28 0.21 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.927 -1.033 . . . . 61.44 111.893 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 55.03 48.9 18.77 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 115.501 -0.772 . . . . 64.03 112.576 178.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -114.27 110.17 19.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.953 -0.567 . . . . 73.13 110.908 176.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.23 -145.56 41.21 Favored Glycine 0 C--O 1.235 0.214 0 CA-C-N 115.655 -0.702 . . . . 75.4 113.495 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -68.38 -34.22 75.66 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.582 0.706 . . . . 71.32 109.442 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.442 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 93.5 mt -59.74 -32.87 70.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.858 -1.065 . . . . 74.32 110.817 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.14 -39.47 97.18 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 121.019 -0.61 . . . . 75.11 112.143 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -76.6 -33.59 47.01 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.179 -0.768 . . . . 63.55 111.179 178.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.801 ' HZ2' ' HD3' ' A' ' 54' ' ' ARG . 38.0 t90 -58.94 -55.17 38.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.159 -0.52 . . . . 74.21 110.388 175.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 50.5 t -62.39 -43.0 99.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.257 -0.883 . . . . 60.24 111.428 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -52.31 -41.6 63.09 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.914 0.339 . . . . 75.44 111.914 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.5 m -73.98 -51.19 16.76 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.145 0.497 . . . . 72.34 111.407 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.623 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 30.4 mt-30 -85.71 -12.98 49.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.713 1.005 . . . . 73.01 113.713 -167.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.417 ' C ' ' HD2' ' A' ' 42' ' ' ARG . 6.2 ppt_? -64.59 -24.5 67.62 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.626 0.727 . . . . 75.14 109.544 173.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -78.77 -46.36 19.02 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.093 -0.958 . . . . 74.21 109.824 176.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.623 ' HG2' ' HA ' ' A' ' 41' ' ' GLN . 12.2 mmt -60.69 -31.03 70.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.542 -0.754 . . . . 64.4 110.512 177.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.427 ' HB2' HD12 ' A' ' 50' ' ' LEU . 23.5 tpt180 -59.11 -45.75 90.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.469 -0.787 . . . . 63.1 110.623 174.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.44 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 0.4 OUTLIER -71.33 -43.89 66.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.076 -0.511 . . . . 73.55 109.651 -179.058 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.437 ' HB2' ' HG2' ' A' ' 49' ' ' LYS . 45.7 mt-30 -65.63 -14.32 60.93 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.608 -0.724 . . . . 74.33 111.791 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.29 26.53 73.34 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.155 -0.545 . . . . 62.52 112.444 178.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.521 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 19.8 ptmt -110.35 -4.58 15.56 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.826 0.346 . . . . 52.23 111.001 -176.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.592 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 3.9 mt -58.9 140.99 86.22 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.835 -0.62 . . . . 75.41 109.933 174.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 50' ' ' LEU . 16.7 Cg_exo -69.81 131.26 20.79 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.881 2.387 . . . . 64.43 112.309 176.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.56 -33.97 72.1 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.399 -0.819 . . . . 73.54 111.001 177.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.721 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 19.1 m-20 -51.91 -53.46 40.64 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.483 0.658 . . . . 75.43 110.028 176.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.801 ' HD3' ' HZ2' ' A' ' 37' ' ' TRP . 33.1 ttm180 -68.14 -48.65 64.82 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.742 -1.117 . . . . 73.44 111.217 -179.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.46 ' HG2' ' CH2' ' A' ' 65' ' ' TRP . 3.6 tmt_? -50.22 -41.48 50.0 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.518 -0.765 . . . . 71.04 110.987 176.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.2 tp -70.38 -36.14 73.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.559 0.218 . . . . 74.23 111.119 -179.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 75.6 mt -61.81 -43.14 99.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.951 0.405 . . . . 44.01 110.698 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.23 -39.15 86.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.839 -0.619 . . . . 73.41 111.159 179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -70.94 -28.83 64.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.103 0.478 . . . . 71.12 110.253 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.46 ' HD2' ' C ' ' A' ' 60' ' ' LYS . 0.4 OUTLIER -66.9 -46.21 75.6 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.932 -0.576 . . . . 72.4 110.279 178.922 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.503 HG21 ' HG2' ' A' ' 17' ' ' LYS . 42.6 pt -72.9 -23.07 20.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.551 -0.295 . . . . 73.03 110.966 -178.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.89 32.4 3.09 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.508 -0.853 . . . . 63.23 112.933 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -74.79 130.23 39.09 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.031 0.443 . . . . 72.14 110.29 177.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.502 HG22 ' H ' ' A' ' 66' ' ' SER . 10.6 p -76.13 134.07 29.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.684 -0.689 . . . . 65.44 110.1 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.46 ' CH2' ' HG2' ' A' ' 55' ' ' ARG . 95.9 m95 -89.75 -12.45 39.31 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.326 -0.397 . . . . 73.15 111.114 -177.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.502 ' H ' HG22 ' A' ' 64' ' ' VAL . 1.7 p -97.31 81.07 2.96 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.507 0.67 . . . . 74.21 110.79 176.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.668 HD23 ' HG3' ' A' ' 68' ' ' GLU . 5.3 tt -93.14 119.35 32.25 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.294 -1.002 . . . . 74.34 108.294 177.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.668 ' HG3' HD23 ' A' ' 67' ' ' LEU . 47.6 mt-10 62.2 -158.22 0.33 Allowed 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.475 0.484 . . . . 72.44 109.759 -172.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.472 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 71.9 m-70 68.56 137.49 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.827 0.704 . . . . 72.33 111.98 175.464 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -151.1 118.1 5.88 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.854 -0.612 . . . . 71.33 110.57 178.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -107.87 138.19 44.55 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.302 -0.629 . . . . 71.34 109.302 178.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -70.67 111.76 6.39 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.194 0.521 . . . . 63.14 111.771 -176.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 -110.8 83.31 1.74 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.433 -0.951 . . . . 71.45 108.433 173.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 47.3 t60 . . . . . 0 C--O 1.247 0.921 0 CA-C-O 118.253 -0.88 . . . . 72.22 109.7 -174.911 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ttt . . . . . 0 N--CA 1.48 1.072 0 CA-C-O 120.786 0.327 . . . . 71.01 110.469 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -73.86 135.51 43.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.297 -0.41 . . . . 73.24 110.289 177.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -76.35 105.39 7.38 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.15 0.5 . . . . 65.33 110.054 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -89.5 106.33 18.39 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.357 -0.838 . . . . 64.4 111.083 -176.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.41 ' HB3' ' H ' ' A' ' 6' ' ' GLN . 10.9 mp 59.25 -155.07 0.36 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.639 -0.709 . . . . 73.15 111.96 174.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.41 ' H ' ' HB3' ' A' ' 5' ' ' LEU . 10.4 pt20 -144.35 166.06 26.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.329 -0.851 . . . . 74.42 109.723 -178.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.23 42.2 4.68 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.57 -0.824 . . . . 42.04 111.358 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -63.3 -21.32 66.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.755 -0.223 . . . . 64.22 111.188 -177.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.512 ' O ' ' HE3' ' A' ' 9' ' ' TRP . 0.0 OUTLIER -56.34 -47.73 78.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.755 0.312 . . . . 54.0 110.296 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 tpt -55.37 -43.27 74.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.18 0.514 . . . . 62.53 110.321 177.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -66.6 -44.22 82.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.182 -0.917 . . . . 62.3 110.366 -178.773 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -65.64 -33.04 74.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.236 0.541 . . . . 74.24 110.787 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.431 ' CE2' ' HD2' ' A' ' 17' ' ' LYS . 91.5 t80 -63.99 -53.48 49.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 73.52 110.901 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -63.16 -32.27 73.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.273 -0.421 . . . . 74.45 111.336 -176.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 11' ' ' LYS . 47.7 mt-10 -63.69 -42.4 97.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.821 0.343 . . . . 74.13 110.979 177.269 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.467 ' O ' HD23 ' A' ' 16' ' ' LEU . 4.4 tt -79.51 -36.19 38.92 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.898 -0.778 . . . . 64.42 108.898 -174.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.431 ' HD2' ' CE2' ' A' ' 13' ' ' TYR . 61.1 tttm -53.75 -44.79 70.28 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.694 -1.139 . . . . 72.53 110.879 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 58.4 m -82.25 -32.95 29.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.851 -0.613 . . . . 71.01 111.33 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -64.83 -47.25 78.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.819 0.342 . . . . 71.01 110.921 -177.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.521 HG11 HD12 ' A' ' 61' ' ' ILE . 8.7 p -65.61 -33.77 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.274 -0.421 . . . . 72.31 110.511 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.76 -25.27 62.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.234 0.54 . . . . 61.33 109.9 179.564 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -93.17 -56.07 3.09 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.612 -0.722 . . . . 65.41 111.553 -176.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -90.54 -15.93 29.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.159 -0.473 . . . . 75.51 111.567 -174.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.449 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 9.6 mmm180 58.34 88.53 0.06 Allowed 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.878 0.736 . . . . 71.5 110.556 -174.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.518 ' HG2' ' N ' ' A' ' 26' ' ' PHE . 37.8 ttt-85 67.24 167.34 0.24 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.698 -1.137 . . . . 72.31 111.117 -176.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.518 ' N ' ' HG2' ' A' ' 25' ' ' ARG . 52.7 m-85 -78.76 144.93 65.5 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.075 -0.713 . . . . 74.34 109.075 174.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.431 ' HD2' ' OE1' ' A' ' 31' ' ' GLU . 52.2 Cg_exo -53.06 -50.84 12.63 Favored 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.288 1.992 . . . . 71.2 110.884 174.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -172.65 -47.78 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.542 -0.754 . . . . 73.11 109.778 173.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 77.9 p -178.39 -162.49 0.06 Allowed 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.219 -0.66 . . . . 53.45 109.219 178.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.17 20.15 11.9 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.306 0.574 . . . . 72.53 111.851 -178.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.431 ' OE1' ' HD2' ' A' ' 27' ' ' PRO . 1.0 OUTLIER -80.61 -172.93 3.86 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.15 -0.477 . . . . 63.24 109.893 171.851 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.84 -133.42 0.54 Allowed Glycine 0 CA--C 1.517 0.182 0 C-N-CA 120.697 -0.764 . . . . 75.34 112.155 177.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -60.96 -29.77 69.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.845 0.355 . . . . 60.02 110.784 179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.474 ' HB3' ' HE1' ' A' ' 26' ' ' PHE . 82.4 mt -66.73 -30.94 71.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 72.35 110.803 176.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -66.54 -36.66 91.76 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.793 -0.923 . . . . 64.4 110.793 174.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.21 -38.12 63.26 Favored Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.173 -0.771 . . . . 70.03 111.173 174.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -56.27 -49.24 74.8 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.907 -0.405 . . . . 75.23 109.907 174.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.76 -51.26 70.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.622 -0.717 . . . . 72.14 110.635 178.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -56.71 -46.85 81.03 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.139 -0.482 . . . . 74.22 111.232 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.567 ' O ' ' HG2' ' A' ' 44' ' ' MET . 51.7 m -61.84 -42.58 99.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.222 -0.445 . . . . 72.13 110.926 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -64.78 -27.05 68.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 51.44 111.744 -175.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 42' ' ' ARG . 1.2 tmt_? -58.77 -36.99 75.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.402 -0.363 . . . . 71.4 110.217 177.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.438 ' CE ' ' HA ' ' A' ' 40' ' ' THR . 0.0 OUTLIER -84.07 -34.78 24.13 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.932 -0.307 . . . . 74.55 110.501 178.131 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.567 ' HG2' ' O ' ' A' ' 40' ' ' THR . 25.3 mmt -55.16 -38.94 68.92 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.269 -0.423 . . . . 74.21 111.413 -176.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.525 ' HB3' HD12 ' A' ' 50' ' ' LEU . 10.9 ptm180 -72.33 -34.5 68.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.728 0.299 . . . . 74.23 111.021 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.77 -30.41 59.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.231 -0.655 . . . . 73.32 109.231 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -77.25 -16.99 58.77 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.392 -0.822 . . . . 51.33 110.462 174.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 74.24 24.44 73.35 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.965 -0.561 . . . . 74.25 112.642 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' A' ' 49' ' ' LYS . 19.3 ptmt -109.13 -3.04 17.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.646 0.26 . . . . 54.02 111.455 -177.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.875 HD23 ' HD2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -64.65 139.07 97.66 Favored Pre-proline 0 C--N 1.322 -0.611 0 N-CA-C 109.644 -0.502 . . . . 62.23 109.644 176.774 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.875 ' HD2' HD23 ' A' ' 50' ' ' LEU . 2.6 Cg_exo -78.56 124.22 6.28 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.678 2.252 . . . . 74.25 111.753 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -61.06 -31.14 70.8 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.612 -0.722 . . . . 41.01 109.835 175.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.727 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 3.2 m-20 -57.56 -52.39 65.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.495 -0.775 . . . . 65.23 109.671 174.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HG3' ' CH2' ' A' ' 9' ' ' TRP . 0.1 OUTLIER -67.42 -31.88 72.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.779 -0.646 . . . . 74.42 110.119 -178.866 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.8 tmt_? -60.9 -43.91 97.88 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.307 -0.627 . . . . 72.42 109.307 176.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 65.8 tp -72.48 -41.91 65.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.0 -0.546 . . . . 73.52 110.508 178.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 79.1 mt -58.03 -43.31 86.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.845 0.355 . . . . 73.44 110.466 177.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.676 HD12 HD11 ' A' ' 61' ' ' ILE . 21.2 tp -64.77 -44.56 89.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.675 -0.693 . . . . 53.24 110.403 -178.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -63.19 -38.01 89.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.156 -0.475 . . . . 72.5 110.322 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -70.84 -36.55 72.95 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.906 -0.588 . . . . 75.32 111.997 -176.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.676 HD11 HD12 ' A' ' 58' ' ' LEU . 10.7 pt -74.56 -3.66 4.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.758 0.313 . . . . 54.53 111.75 -178.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.6 20.06 8.37 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.311 -0.947 . . . . 43.52 113.497 173.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -87.54 119.72 28.11 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.199 0.523 . . . . 73.21 110.559 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.483 ' CG1' ' HD2' ' A' ' 25' ' ' ARG . 14.4 p -93.47 128.41 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 CA-C-N 115.473 -0.785 . . . . 42.21 110.293 177.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.475 ' CH2' HD23 ' A' ' 58' ' ' LEU . 42.0 m95 -80.78 -32.47 35.39 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.646 -0.706 . . . . 72.32 110.813 -174.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.7 m -73.58 128.68 36.17 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.85 -0.614 . . . . 65.25 110.843 -178.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 65.5 tp -88.91 127.77 35.66 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.019 -0.537 . . . . 62.35 110.64 -178.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 63.68 15.62 9.09 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.572 0.701 . . . . 71.41 111.004 176.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -101.69 50.69 0.84 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.545 0.688 . . . . 71.43 109.856 177.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -66.23 117.74 8.95 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.009 -0.996 . . . . 64.31 109.847 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 29.6 m80 -64.76 125.14 23.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.338 -0.392 . . . . 72.14 111.141 -173.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -138.2 92.8 2.68 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.929 -0.578 . . . . 71.43 110.457 174.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -75.98 -18.04 59.46 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.401 0.619 . . . . 74.44 109.637 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 43.4 p-80 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 117.835 -1.079 . . . . 75.34 108.514 174.788 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptt? . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 110.281 -0.266 . . . . 74.35 110.281 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -144.24 147.58 33.77 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.933 0.397 . . . . 71.34 110.355 177.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -161.84 98.61 1.09 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.703 -0.851 . . . . 70.14 108.703 179.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -59.95 149.37 32.06 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.287 0.565 . . . . 42.23 111.896 -175.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.0 tp -71.26 137.21 48.41 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.335 -0.848 . . . . 73.33 109.34 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.2 tp60 -73.62 96.0 2.4 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.99 0.424 . . . . 74.13 110.442 -177.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.81 136.64 22.13 Favored Glycine 0 N--CA 1.444 -0.767 0 N-CA-C 110.525 -1.03 . . . . 52.43 110.525 175.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -26.69 65.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 117.05 0.425 . . . . 53.03 110.623 -174.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 7.3 t-105 -58.63 -51.3 70.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.707 -0.224 . . . . 70.51 111.199 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.459 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -59.84 -31.2 69.52 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.119 0.485 . . . . 52.5 110.381 -179.193 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.68 -48.24 15.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.924 -0.58 . . . . 73.15 110.058 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -65.28 -32.89 74.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-N 116.326 -0.397 . . . . 73.33 111.792 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -65.77 -53.31 42.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.822 0.344 . . . . 73.44 110.195 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.738 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 65.3 mm-40 -61.21 -31.98 71.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.302 0.572 . . . . 74.25 110.032 176.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -63.21 -52.24 63.06 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.081 -0.963 . . . . 74.54 110.095 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.4 tp -61.04 -44.72 96.98 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.725 -0.671 . . . . 70.21 111.133 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.738 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.9 mtpt -51.49 -58.42 6.32 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 121.501 0.667 . . . . 54.33 109.881 176.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.9 m -61.79 -42.53 99.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.562 -1.199 . . . . 73.14 111.838 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.473 ' CE2' ' HB3' ' A' ' 26' ' ' PHE . 26.4 t80 -67.18 -46.59 73.48 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.63 0.252 . . . . 64.05 110.799 -176.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 t -66.46 -39.38 83.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.957 -0.297 . . . . 73.34 110.678 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -60.94 -25.71 66.98 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.007 0.432 . . . . 71.53 110.203 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -92.77 -58.34 2.38 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.257 -0.429 . . . . 75.11 112.141 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -100.81 -30.04 11.92 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.207 0.447 . . . . 44.22 112.207 -170.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.516 ' O ' ' HB2' ' A' ' 25' ' ' ARG . 0.3 OUTLIER 64.27 94.65 0.05 Allowed 'General case' 0 CA--C 1.517 -0.305 0 O-C-N 123.846 0.716 . . . . 71.34 110.461 -168.379 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 24' ' ' ARG . 9.2 mmm180 75.61 168.31 0.27 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 114.316 -1.311 . . . . 73.02 111.185 -177.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.546 ' CZ ' ' HB3' ' A' ' 34' ' ' LEU . 0.3 OUTLIER -132.34 84.61 51.41 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.523 -0.762 . . . . 75.41 110.067 177.636 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.62 132.45 35.43 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.647 2.232 . . . . 65.34 111.614 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.1 tttt 66.11 27.14 10.57 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.47 0.652 . . . . 74.2 109.45 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 52.2 p 49.9 68.45 0.74 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 114.924 -1.035 . . . . 64.52 111.615 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -60.55 -35.23 75.52 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.46 -0.791 . . . . 63.24 111.031 178.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.473 ' HG2' HD23 ' A' ' 34' ' ' LEU . 11.3 tp10 -112.85 121.64 45.28 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.858 -0.61 . . . . 45.43 109.493 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.63 -34.64 90.43 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.005 -0.617 . . . . 75.15 112.489 -178.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -60.5 -55.12 37.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.931 0.396 . . . . 71.43 111.183 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 26' ' ' PHE . 3.6 mm? -74.37 -26.68 60.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.143 -0.48 . . . . 75.11 110.709 -179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -61.1 -39.88 97.74 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 111.61 -0.596 . . . . 70.25 111.61 176.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.57 -35.62 75.09 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.866 -0.683 . . . . 73.23 111.479 176.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -60.04 -49.81 76.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.119 0.485 . . . . 74.21 109.946 177.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 34.1 m -70.33 -33.23 71.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.739 -0.664 . . . . 75.34 111.928 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -53.42 -37.08 62.21 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.799 0.333 . . . . 73.34 111.309 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 39.7 m -77.95 -44.55 26.48 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.893 -0.594 . . . . 62.42 111.369 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.444 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 27.8 mt-30 -84.84 -19.23 32.75 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.43 0.9 . . . . 61.41 113.43 -170.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.65 -26.75 68.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.126 0.489 . . . . 73.03 109.936 175.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -70.55 -45.48 65.39 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.526 -0.761 . . . . 65.22 109.631 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.791 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 11.5 mmt -65.94 -33.51 75.99 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.766 -0.652 . . . . 73.31 110.774 -178.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.649 ' HB2' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -68.43 -47.05 68.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 73.51 110.082 178.76 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.406 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 0.3 OUTLIER -63.54 -45.65 89.56 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.784 -0.643 . . . . 75.1 109.444 179.819 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.488 ' HB3' ' HE2' ' A' ' 49' ' ' LYS . 1.2 tp-100 -67.6 -31.01 70.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 72.54 110.909 -178.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.84 41.24 4.73 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 121.206 -0.521 . . . . 75.4 113.385 174.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HE2' ' HB3' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -131.96 2.62 4.01 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 117.212 0.506 . . . . 64.03 111.455 177.654 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.791 ' HG ' ' HB2' ' A' ' 44' ' ' MET . 5.1 mt -54.24 140.0 54.96 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.721 -0.392 . . . . 71.51 110.434 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.6 140.52 81.7 Favored 'Trans proline' 0 C--O 1.235 0.358 0 C-N-CA 123.262 2.641 . . . . 73.44 113.002 178.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.485 ' O ' ' HG3' ' A' ' 55' ' ' ARG . 18.1 m120 -64.3 -29.05 70.15 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.057 -0.974 . . . . 74.33 110.754 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -70.26 -44.27 68.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.066 0.46 . . . . 74.02 109.828 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' A' ' 54' ' ' ARG . 26.5 mmt180 -59.17 -51.8 68.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.623 -0.717 . . . . 71.25 110.987 177.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -66.02 -27.58 68.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.314 -0.403 . . . . 74.33 110.452 -175.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -77.32 -44.2 30.4 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.711 0.291 . . . . 72.41 110.503 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.1 tp -59.46 -45.89 90.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.977 -0.556 . . . . 71.22 110.822 -178.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.532 ' HB3' ' HB3' ' A' ' 63' ' ' PHE . 10.5 mp -66.05 -45.0 82.91 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.903 -0.589 . . . . 50.42 110.472 178.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.12 -28.25 69.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.287 0.565 . . . . 65.43 110.56 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.23 -53.55 19.3 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-N 115.792 -0.64 . . . . 54.14 110.959 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 14.0 pt -68.49 -19.86 24.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.682 0.277 . . . . 40.25 111.728 -176.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.98 22.72 4.14 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.591 -0.814 . . . . 65.24 112.601 176.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.532 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 45.3 t80 -83.78 103.7 13.29 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.416 0.627 . . . . 70.21 109.723 178.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 9.9 p -82.62 151.74 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.771 0 CA-C-N 115.059 -0.973 . . . . 73.25 110.044 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -93.81 25.95 3.37 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.764 0.316 . . . . 73.0 110.81 -175.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 27.5 m -71.18 95.78 1.3 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.443 0.639 . . . . 54.25 110.66 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.5 pp -144.38 155.2 43.67 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.347 -0.842 . . . . 62.4 109.144 178.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -103.71 120.08 40.2 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.21 0.529 . . . . 75.01 111.178 -176.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 55.0 t-80 -161.44 112.53 1.73 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.35 -0.841 . . . . 61.51 109.47 178.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -60.66 130.29 45.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.18 -0.464 . . . . 64.24 110.532 -178.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -105.09 123.65 48.18 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.334 -0.617 . . . . 64.42 109.334 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -117.04 134.95 54.11 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.329 -0.396 . . . . 74.21 110.7 -173.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -145.15 151.56 38.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.732 0.301 . . . . 73.22 111.28 176.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.571 -0.728 . . . . 71.0 109.671 172.226 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.753 ' HB3' HE22 ' A' ' 3' ' ' GLN . 65.1 mtt . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 120.702 0.286 . . . . 72.44 110.324 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -134.34 104.39 6.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.124 0.488 . . . . 71.04 110.562 176.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.753 HE22 ' HB3' ' A' ' 1' ' ' MET . 27.5 mp0 -119.47 -23.3 6.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.644 -0.707 . . . . 73.51 109.658 175.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -118.12 149.0 41.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.779 -0.646 . . . . 51.04 110.345 -178.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.1 mp 60.13 45.41 11.79 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.913 0.863 . . . . 70.21 110.116 -178.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -74.56 -169.88 0.93 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.394 -1.275 . . . . 73.03 110.572 -178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.0 54.72 3.07 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.999 -0.62 . . . . 54.34 112.039 176.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -76.08 -33.15 59.52 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.509 -0.552 . . . . 63.41 109.509 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.563 ' HZ3' ' HZ2' ' A' ' 37' ' ' TRP . 25.6 t-105 -48.79 -50.58 33.54 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.1 -0.955 . . . . 74.22 112.584 -179.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.514 ' HA ' ' CE ' ' A' ' 10' ' ' MET . 2.4 tpt -53.69 -39.03 64.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.235 0.54 . . . . 74.32 110.63 -177.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HE2' ' HB3' ' A' ' 11' ' ' LYS . 4.5 tmmm? -75.42 -41.93 54.76 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.637 -0.71 . . . . 72.44 110.199 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -59.0 -38.8 80.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.831 -0.622 . . . . 65.22 111.092 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -60.93 -48.18 83.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 74.45 110.371 177.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.664 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 70.6 mm-40 -64.68 -38.97 92.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 71.14 110.697 178.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.402 ' HG2' HD22 ' A' ' 33' ' ' ASN . 5.2 tp10 -60.28 -45.2 94.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.887 -0.597 . . . . 72.33 109.692 178.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.5 ' HA ' HD11 ' A' ' 34' ' ' LEU . 33.0 tp -58.95 -47.34 85.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 72.31 110.946 178.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.664 ' HD3' ' HA ' ' A' ' 14' ' ' GLU . 54.3 mtpt -54.99 -55.73 27.65 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.22 0.533 . . . . 71.53 110.765 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.8 t -55.74 -47.26 77.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.204 -0.907 . . . . 52.1 111.069 178.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.56 ' HE2' ' HB3' ' A' ' 26' ' ' PHE . 42.2 t80 -65.26 -46.78 79.13 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.274 -0.421 . . . . 74.11 111.292 -176.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.556 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 9.4 p -68.09 -32.56 56.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 CA-C-N 116.311 -0.404 . . . . 62.43 110.896 -178.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.482 ' HD3' ' O ' ' A' ' 21' ' ' ARG . 3.6 tmt_? -70.94 -19.08 62.61 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.199 0.524 . . . . 74.03 110.179 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -85.16 -61.51 1.75 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.939 -0.573 . . . . 65.52 111.445 -175.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -97.13 -19.0 18.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.767 0.318 . . . . 73.13 110.777 -176.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.556 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 0.1 OUTLIER 60.81 93.59 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.419 -0.81 . . . . 65.34 110.546 -168.36 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.516 ' H ' HG23 ' A' ' 20' ' ' VAL . 63.0 ttt180 65.21 158.64 0.1 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.445 -1.252 . . . . 73.11 112.184 -172.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.56 ' HB3' ' HE2' ' A' ' 19' ' ' PHE . 11.2 p90 -119.36 143.76 35.08 Favored Pre-proline 0 C--N 1.317 -0.829 0 CA-C-N 114.583 -1.19 . . . . 75.22 109.387 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 26' ' ' PHE . 3.5 Cg_exo -74.79 -54.44 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 122.512 2.141 . . . . 65.02 111.369 178.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -152.29 99.04 2.47 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.382 -0.97 . . . . 74.11 108.382 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 31.4 t -105.56 137.0 44.13 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.37 0.605 . . . . 73.31 112.079 -170.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -130.66 23.31 5.05 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.921 -1.036 . . . . 74.44 109.489 170.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -84.92 86.33 7.38 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.37 -0.832 . . . . 64.2 111.11 -176.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 50.06 -108.67 0.52 Allowed Glycine 0 C--N 1.331 0.302 0 CA-C-N 115.548 -0.751 . . . . 65.02 114.201 173.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.402 HD22 ' HG2' ' A' ' 15' ' ' GLU . 75.9 m-20 -63.44 -44.71 93.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.207 -0.497 . . . . 51.33 111.055 -174.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.5 HD11 ' HA ' ' A' ' 16' ' ' LEU . 3.1 mm? -75.13 -24.9 58.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.947 -0.569 . . . . 51.01 110.26 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.49 -36.16 92.77 Favored Glycine 0 N--CA 1.45 -0.387 0 CA-C-N 115.658 -0.701 . . . . 34.13 112.022 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.42 -36.45 49.66 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.564 -0.827 . . . . 61.03 111.661 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.563 ' HZ2' ' HZ3' ' A' ' 9' ' ' TRP . 3.7 m95 -58.91 -49.88 76.14 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.032 0.444 . . . . 71.01 110.596 175.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 53.8 t -61.18 -40.21 93.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.314 -0.857 . . . . 73.31 111.174 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -69.8 -46.66 65.22 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.144 0.424 . . . . 61.24 112.144 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.467 ' O ' ' HG2' ' A' ' 44' ' ' MET . 49.0 m -80.99 -57.52 3.5 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.429 0.529 . . . . 35.31 112.429 -172.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -80.13 -18.46 49.75 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.535 0.939 . . . . 73.35 113.535 -166.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 42' ' ' ARG . 5.4 tmm_? -65.23 -32.12 73.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.194 0.521 . . . . 64.31 109.821 176.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.0 ttmm -76.51 -46.05 28.3 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.734 -0.666 . . . . 54.31 110.551 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.542 ' HB3' ' HG3' ' A' ' 49' ' ' LYS . 11.6 mmt -59.92 -28.75 67.87 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.54 -0.755 . . . . 71.34 111.273 -178.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.2 ttt180 -64.88 -48.94 72.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.032 0.444 . . . . 73.14 110.463 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.502 ' O ' ' HD2' ' A' ' 46' ' ' LYS . 3.3 tmmm? -65.76 -34.7 78.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.354 0.597 . . . . 54.35 109.619 -179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -83.74 1.03 44.72 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.518 -0.764 . . . . 63.14 111.704 -179.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 59.25 34.45 80.15 Favored Glycine 0 C--N 1.333 0.383 0 CA-C-N 116.356 -0.384 . . . . 72.02 113.232 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' HG3' ' HB3' ' A' ' 44' ' ' MET . 17.9 ptmt -119.21 1.9 11.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.161 0.505 . . . . 70.42 110.967 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 mt -61.77 142.22 94.83 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.325 -0.852 . . . . 61.43 110.113 172.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.529 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 26.0 Cg_exo -64.65 120.69 8.03 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.177 1.918 . . . . 75.01 111.038 169.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -56.58 -32.86 65.63 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.98 -0.555 . . . . 73.31 110.42 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -58.31 -41.3 84.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.564 -0.744 . . . . 61.33 110.57 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.529 ' HG2' ' HB2' ' A' ' 51' ' ' PRO . 18.7 mmt180 -62.1 -50.2 72.88 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 116.088 -0.506 . . . . 74.44 110.799 179.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -54.24 -37.81 65.06 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.778 -0.646 . . . . 72.35 110.521 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 tt -68.38 -53.1 26.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 74.42 110.366 178.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 10.2 mp -60.71 -39.39 88.38 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.336 -0.393 . . . . 74.43 111.592 -178.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.59 HD13 HD11 ' A' ' 61' ' ' ILE . 4.0 mm? -61.66 -40.09 93.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.996 0.427 . . . . 62.42 110.787 178.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.664 ' HB2' ' HE1' ' A' ' 65' ' ' TRP . 28.8 t70 -66.7 -35.74 80.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.278 -0.419 . . . . 72.33 110.595 178.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.1 tmmm? -64.51 -42.55 95.74 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 75.14 111.255 -178.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.59 HD11 HD13 ' A' ' 58' ' ' LEU . 6.8 pt -77.76 -17.05 14.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.741 0.305 . . . . 75.35 111.682 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 117.4 29.75 2.04 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.08 -1.057 . . . . 50.2 113.949 172.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -84.57 106.9 16.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.532 -0.544 . . . . 72.12 109.532 175.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.509 ' O ' ' HD2' ' A' ' 25' ' ' ARG . 12.9 p -75.14 133.89 30.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.626 -0.715 . . . . 61.45 110.892 -177.343 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.664 ' HE1' ' HB2' ' A' ' 59' ' ' ASP . 86.8 m95 -101.89 8.85 41.07 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.689 0.28 . . . . 72.3 111.445 -172.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.439 ' H ' HG22 ' A' ' 64' ' ' VAL . 41.0 m -57.98 111.33 1.14 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.061 -0.518 . . . . 63.32 111.582 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 62.0 mt -134.3 174.28 10.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.67 -0.695 . . . . 34.34 109.666 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 63.33 24.81 14.4 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 123.565 0.54 . . . . 73.02 110.829 174.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -59.6 113.66 2.34 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.479 -0.563 . . . . 74.14 109.479 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -53.24 104.81 0.1 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.495 -0.775 . . . . 62.33 112.105 -173.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 35.2 m80 -103.24 -82.89 0.49 Allowed 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.83 -0.804 . . . . 74.12 108.83 171.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -152.21 175.22 12.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.462 -0.79 . . . . 73.24 109.186 175.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -123.1 160.61 26.05 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.697 -0.853 . . . . 72.23 108.697 175.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 . . . . . 0 C--O 1.246 0.878 0 C-N-CA 120.669 -0.413 . . . . 64.52 110.459 178.521 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 120.652 0.263 . . . . 72.53 111.243 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -125.18 121.05 33.03 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.669 -0.493 . . . . 73.11 109.669 176.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -73.09 144.2 47.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.834 0.349 . . . . 64.21 110.797 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 5' ' ' LEU . 31.4 m-80 -88.75 -30.77 18.8 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.275 -0.639 . . . . 72.01 109.275 177.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.437 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 3.3 mm? 70.63 150.74 0.09 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.943 -1.026 . . . . 71.31 110.773 -176.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -89.08 99.59 12.55 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.96 0.409 . . . . 75.42 109.907 179.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.56 84.04 1.2 Allowed Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 120.906 -0.664 . . . . 73.13 111.624 -176.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -60.46 -47.01 88.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.826 0.345 . . . . 43.53 110.621 -177.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.669 ' CZ2' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -76.82 -30.36 56.35 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.416 -0.356 . . . . 75.55 110.844 -176.571 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -38.01 85.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.274 0.559 . . . . 72.03 109.705 175.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.437 ' HE2' ' HB2' ' A' ' 5' ' ' LEU . 25.1 ttmt -70.14 -49.42 50.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.493 -0.776 . . . . 55.02 110.097 174.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.462 ' HB2' ' HA ' ' A' ' 9' ' ' TRP . 74.1 m-20 -54.61 -46.4 73.83 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.19 -0.913 . . . . 75.25 111.511 -178.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.423 ' O ' ' HG3' ' A' ' 17' ' ' LYS . 32.4 t80 -55.65 -48.0 75.71 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.923 -0.581 . . . . 61.45 112.039 -173.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 11' ' ' LYS . 17.1 pt-20 -68.78 -34.85 76.25 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.96 -0.296 . . . . 72.02 111.259 -175.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -76.03 -40.91 52.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.033 0.444 . . . . 75.31 110.121 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.571 HD21 ' CD2' ' A' ' 58' ' ' LEU . 38.2 tp -57.04 -54.17 49.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.334 -0.848 . . . . 55.12 111.723 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 13' ' ' TYR . 8.4 mtpm? -51.79 -52.47 48.76 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.426 0.631 . . . . 70.31 110.556 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.9 m -58.9 -44.62 91.25 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.506 -1.225 . . . . 62.22 111.597 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.685 ' CE1' ' HB3' ' A' ' 26' ' ' PHE . 7.8 t80 -67.41 -52.42 40.04 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.184 -0.462 . . . . 74.53 110.422 -176.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.435 ' O ' ' HA ' ' A' ' 24' ' ' ARG . 78.1 t -60.1 -33.91 54.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.426 . . . . 75.53 111.621 178.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 21' ' ' ARG . 1.6 tmt_? -61.41 -26.84 68.13 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.377 -0.374 . . . . 75.33 111.106 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -108.94 -52.8 2.72 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.458 -0.337 . . . . 73.31 111.379 -178.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' A' ' 24' ' ' ARG . 88.4 m-85 -90.7 -15.61 30.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.749 0.278 . . . . 64.35 111.749 -174.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.515 ' O ' ' HA ' ' A' ' 63' ' ' PHE . 26.6 mmt180 75.06 -18.46 0.44 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.632 0.773 . . . . 74.42 112.861 -178.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.522 ' HG3' ' HD3' ' A' ' 27' ' ' PRO . 25.9 ptt180 177.16 174.0 0.45 Allowed 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.858 -0.423 . . . . 74.4 109.858 179.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.685 ' HB3' ' CE1' ' A' ' 19' ' ' PHE . 7.7 p90 -138.8 85.6 16.5 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 121.265 0.555 . . . . 71.44 111.363 177.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.522 ' HD3' ' HG3' ' A' ' 25' ' ' ARG . 63.3 Cg_endo -76.19 -15.22 18.33 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.273 1.982 . . . . 71.34 110.914 173.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.417 ' HB2' ' HE3' ' A' ' 28' ' ' LYS . 37.0 ttmt -145.6 81.31 1.61 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.874 -1.057 . . . . 74.44 108.649 179.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.682 ' HB2' ' HB2' ' A' ' 26' ' ' PHE . 32.1 t -95.36 -50.21 5.12 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.084 -0.507 . . . . 71.31 110.594 -174.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 65.69 -46.07 0.39 Allowed 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.121 0.969 . . . . 63.22 113.604 -179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.02 162.24 13.32 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.959 0.725 . . . . 65.13 112.959 -171.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 69.69 -175.9 33.25 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 114.909 -1.041 . . . . 32.51 112.743 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -69.44 -27.2 65.05 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.112 -0.699 . . . . 72.53 109.112 176.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.2 mt -63.64 -43.88 95.5 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.441 -0.8 . . . . 71.33 110.934 177.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.604 ' HA2' ' HB3' ' A' ' 29' ' ' SER . . . -51.82 -42.5 53.24 Favored Glycine 0 C--N 1.337 0.632 0 C-N-CA 120.838 -0.696 . . . . 31.41 112.743 176.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -80.94 -34.49 27.03 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.313 -0.946 . . . . 43.53 112.261 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.504 ' O ' ' HB2' ' A' ' 41' ' ' GLN . 17.2 t90 -57.17 -49.26 76.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.983 -0.377 . . . . 75.12 109.983 177.191 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.664 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 42.3 t -58.34 -50.72 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.919 -0.582 . . . . 74.51 110.63 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -61.62 -37.51 84.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.929 -0.578 . . . . 74.53 112.257 -176.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 m -82.78 -36.28 25.79 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.902 0.382 . . . . 65.11 111.405 -177.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.799 ' HG3' HD21 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -72.58 -18.29 61.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 73.1 111.581 -176.447 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 38' ' ' CYS . 18.0 mmt180 -52.78 -47.63 67.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.354 0.597 . . . . 71.41 109.954 173.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 47' ' ' GLN . 1.2 tmmm? -70.29 -42.12 72.46 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.074 -0.967 . . . . 71.14 110.827 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.659 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 13.5 mmt -64.11 -35.85 82.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.233 0.54 . . . . 72.42 110.651 -177.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.595 ' CB ' HD12 ' A' ' 50' ' ' LEU . 2.2 tmm_? -69.42 -49.66 53.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.334 -0.848 . . . . 70.15 110.17 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.02 -31.58 68.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.157 -0.474 . . . . 63.51 110.646 -177.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.524 ' HB3' ' HG2' ' A' ' 49' ' ' LYS . 4.1 tp-100 -72.74 -22.12 60.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.044 -0.525 . . . . 61.21 110.575 179.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.42 37.52 27.39 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.728 -0.749 . . . . 64.44 111.98 -178.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.524 ' HG2' ' HB3' ' A' ' 47' ' ' GLN . 19.2 ptmt -121.06 -1.3 9.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.189 0.519 . . . . 74.32 110.917 177.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.799 HD21 ' HG3' ' A' ' 41' ' ' GLN . 7.0 mt -68.97 142.58 93.5 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.768 -0.651 . . . . 64.43 110.09 172.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -73.67 138.32 26.35 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 123.0 2.466 . . . . 74.32 111.54 174.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -72.37 -34.8 68.22 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.161 -0.927 . . . . 75.11 112.457 -176.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.628 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 36.0 m-20 -54.76 -51.86 64.38 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.872 0.367 . . . . 73.35 110.546 -177.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.669 ' HG3' ' CZ2' ' A' ' 9' ' ' TRP . 2.8 ttp85 -55.58 -38.88 69.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 70.51 111.301 177.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -59.8 -43.76 94.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.051 0.453 . . . . 72.41 110.539 -179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -74.33 -33.32 63.12 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.9 -0.591 . . . . 74.55 110.654 -177.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 53' ' ' ASP . 88.2 mt -60.96 -36.45 79.44 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 72.5 110.633 177.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.656 HD12 ' CZ2' ' A' ' 65' ' ' TRP . 23.9 mt -63.61 -37.9 89.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.055 -0.521 . . . . 75.12 110.241 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.27 -25.91 68.26 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.942 -0.572 . . . . 73.4 111.187 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -36.19 56.06 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.405 -0.362 . . . . 73.41 110.932 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 5.4 pt -81.53 -12.22 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 120.82 0.343 . . . . 64.22 111.189 177.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 106.85 18.97 10.02 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.585 -0.817 . . . . 64.23 113.073 176.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.549 ' HB3' ' HB3' ' A' ' 58' ' ' LEU . 42.6 t80 -76.63 107.17 8.73 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.001 -0.74 . . . . 74.12 109.001 176.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.73 HG22 ' H ' ' A' ' 66' ' ' SER . 13.2 p -78.3 130.96 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 CA-C-N 115.346 -0.843 . . . . 75.35 111.224 -175.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.656 ' CZ2' HD12 ' A' ' 58' ' ' LEU . 99.8 m95 -93.8 18.42 10.35 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.611 -0.722 . . . . 74.21 110.51 178.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.73 ' H ' HG22 ' A' ' 64' ' ' VAL . 8.4 t 64.1 -165.1 0.24 Allowed 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.206 -0.906 . . . . 63.11 110.79 -179.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.656 ' HG ' ' H ' ' A' ' 68' ' ' GLU . 21.8 tp 65.89 178.47 0.21 Allowed 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.667 0.604 . . . . 63.44 110.097 -177.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.656 ' H ' ' HG ' ' A' ' 67' ' ' LEU . 42.7 tt0 -83.12 78.62 9.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.365 0.602 . . . . 74.42 110.942 -178.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -98.97 90.0 4.48 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.677 -0.692 . . . . 72.43 109.572 172.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -75.53 101.64 4.95 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.211 -0.663 . . . . 74.02 109.211 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -80.8 106.8 13.09 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.847 -0.615 . . . . 63.1 110.582 -173.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -87.58 132.67 33.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.087 -0.506 . . . . 71.32 110.215 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.0 p80 -78.86 148.59 32.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.978 0.418 . . . . 54.33 110.345 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.6 p80 . . . . . 0 C--O 1.247 0.966 0 CA-C-N 115.921 -0.582 . . . . 73.43 109.512 179.31 . . . . . . . . 0 0 . 1 stop_ save_