data_2l7k_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 2l7k _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 ' 4' ' ' LEU . . . . . . . . . . . . . 98.4 mt . . . . . 0 C--O 1.236 0.365 0 CA-C-O 120.497 0.189 . . . . 75.12 110.749 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.4 p -82.41 175.15 10.46 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.22 -0.445 . . . . 75.54 111.043 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.46 -38.37 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.303 -0.408 . . . . 73.12 110.34 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.72 -44.61 95.78 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 122.903 0.481 . . . . 75.31 110.989 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.434 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 46.3 mt-10 -65.79 -51.49 58.65 Favored 'General case' 0 CA--C 1.526 0.035 0 O-C-N 124.194 0.934 . . . . 75.23 112.413 -176.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.0 m -74.18 -28.51 61.32 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 123.346 0.404 . . . . 71.02 111.759 -173.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -70.89 -32.92 70.04 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.385 -0.197 . . . . 74.04 111.437 176.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.45 HD11 HD12 ' A' ' 14' ' ' ILE . 54.8 tp -70.89 -35.52 72.36 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.621 0.248 . . . . 74.03 110.859 175.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.812 HD21 HD22 ' A' ' 23' ' ' LEU . 85.4 mt -67.07 -31.81 72.56 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 116.112 -0.495 . . . . 74.23 110.844 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -65.53 -25.3 67.39 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.841 0.857 . . . . 74.24 111.822 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.45 HD12 HD11 ' A' ' 11' ' ' LEU . 68.7 mt -72.54 -31.36 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 C-N-CA 123.213 0.605 . . . . 72.24 111.074 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -123.26 8.22 9.12 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 113.441 0.904 . . . . 72.53 113.441 -173.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.28 106.38 1.09 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.335 0.654 . . . . 72.44 112.316 -178.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -166.18 125.2 1.57 Allowed 'General case' 0 C--O 1.222 -0.384 0 O-C-N 124.127 0.892 . . . . 73.32 109.606 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.73 38.02 24.98 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.355 -0.45 . . . . 72.42 113.129 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.33 -147.66 36.25 Favored Glycine 0 C--N 1.334 0.468 0 N-CA-C 111.688 -0.565 . . . . 71.34 111.688 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.525 ' HZ3' ' HG3' ' A' ' 21' ' ' ARG . 2.9 pptp? -93.28 -18.76 22.08 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.429 0.157 . . . . 75.33 110.63 177.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.525 ' HG3' ' HZ3' ' A' ' 20' ' ' LYS . 18.5 mtp85 -65.93 -57.06 8.72 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.032 -0.531 . . . . 74.51 110.802 174.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.6 -29.0 74.17 Favored Glycine 0 C--O 1.209 -1.436 0 O-C-N 124.028 0.83 . . . . 62.13 112.659 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.812 HD22 HD21 ' A' ' 12' ' ' LEU . 26.3 tp -62.38 -44.57 96.14 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.191 0.596 . . . . 73.01 111.47 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.465 ' HG2' HD23 ' A' ' 46' ' ' LEU . 62.9 mtt -69.46 -36.7 76.84 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 122.514 0.326 . . . . 62.42 111.383 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 39.8 mm-40 -73.25 -30.91 63.79 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 123.29 0.369 . . . . 71.25 111.003 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -68.62 -47.77 65.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.154 0.582 . . . . 74.2 111.182 174.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.639 HG22 ' HE3' ' A' ' 34' ' ' MET . 44.7 mt -66.05 -48.11 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 O-C-N 123.647 0.592 . . . . 74.32 111.319 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.563 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 20.2 m-80 -70.61 -26.17 63.37 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.234 0.827 . . . . 75.43 113.234 -175.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.37 -28.09 41.92 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.688 0.28 . . . . 62.52 111.38 175.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.697 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -105.23 18.22 22.68 Favored 'General case' 0 C--O 1.221 -0.427 0 N-CA-C 112.18 0.437 . . . . 74.34 112.18 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.779 HD21 ' HG3' ' A' ' 39' ' ' ARG . 86.6 mt -60.19 -47.51 96.58 Favored Pre-proline 0 CA--C 1.554 1.119 0 N-CA-C 113.478 0.918 . . . . 74.33 113.478 176.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.07 -14.48 35.15 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.824 1.683 . . . . 74.22 113.747 175.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.697 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 70.3 m-85 -94.98 -8.43 36.94 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.843 0.354 . . . . 73.42 110.421 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.639 ' HE3' HG22 ' A' ' 27' ' ' ILE . 6.5 ttm -93.82 164.05 13.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.863 -0.608 . . . . 75.4 110.333 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.39 153.69 41.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.491 -0.777 . . . . 74.4 109.545 174.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.26 -41.6 97.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.983 0.364 . . . . 74.14 111.983 -179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.71 -34.78 72.3 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.867 0.365 . . . . 62.43 110.596 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.5 mtt -66.02 -36.52 83.49 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 115.65 -0.705 . . . . 74.4 112.328 174.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.779 ' HG3' HD21 ' A' ' 31' ' ' LEU . 48.8 ttp180 -74.49 -39.81 62.23 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.766 0.427 . . . . 72.34 111.661 -177.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -72.36 -29.04 63.42 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.831 0.348 . . . . 73.21 111.425 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.0 tp -72.09 -35.01 69.1 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.176 -0.466 . . . . 72.42 110.527 172.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.74 96.43 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 112.875 0.694 . . . . 62.15 112.875 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -70.18 -26.62 63.98 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.242 0.339 . . . . 73.3 111.849 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 -74.57 -42.37 58.88 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.437 0.295 . . . . 75.33 111.657 175.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.418 HG21 ' HB3' ' A' ' 8' ' ' GLU . 5.2 m -78.79 -33.6 46.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 73.05 112.213 -175.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.561 HD21 HD13 ' A' ' 27' ' ' ILE . 59.4 mt -69.85 -28.06 65.36 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 122.24 -0.288 . . . . 72.04 111.498 176.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.73 -17.62 62.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 122.564 0.346 . . . . 73.11 111.791 174.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -77.86 -32.26 51.9 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 122.471 0.308 . . . . 75.12 110.601 174.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.474 HG22 HD13 ' A' ' 52' ' ' LEU . 1.8 mt -98.94 -7.12 9.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.036 -0.529 . . . . 74.23 110.68 -175.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.29 -46.68 99.77 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-O 118.094 -0.955 . . . . 60.54 113.327 171.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.51 8.0 4.18 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.788 1.674 . . . . 72.41 114.294 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.474 HD13 HG22 ' A' ' 49' ' ' ILE . 78.1 mt -108.72 168.73 9.13 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.752 0.31 . . . . 72.21 110.81 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -110.37 -168.92 1.37 Allowed 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.159 -0.473 . . . . 74.34 110.602 174.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.466 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 2.9 mp0 -68.03 -29.0 67.88 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.927 0.491 . . . . 74.12 110.549 171.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.17 -45.99 71.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.435 0.694 . . . . 73.14 111.125 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -72.29 -33.58 67.52 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.347 0.499 . . . . 75.53 112.347 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.494 ' HD1' HD11 ' A' ' 60' ' ' LEU . 53.3 t80 -75.85 -25.08 55.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.094 0.247 . . . . 74.21 110.941 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.08 60.14 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.362 -0.211 . . . . 70.25 111.561 175.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.77 -32.96 58.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.423 0.289 . . . . 72.53 110.832 172.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.494 HD11 ' HD1' ' A' ' 57' ' ' TYR . 47.3 mt -70.8 -59.83 2.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.188 -0.671 . . . . 74.21 109.188 173.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.58 28.6 12.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.733 1.613 . . . . 73.1 113.832 171.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 33.1 mm 62.04 89.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.493 0 C-N-CA 124.562 1.145 . . . . 70.45 110.77 -171.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -97.03 -39.35 9.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.713 -1.131 . . . . 73.21 110.532 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -105.9 76.44 1.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.255 0.55 . . . . 64.4 112.364 -173.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.376 0 CA-C-N 115.166 -0.925 . . . . 73.21 110.13 172.128 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.8 mt . . . . . 0 C--O 1.238 0.478 0 N-CA-C 109.513 -0.551 . . . . 71.31 109.513 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -82.57 174.63 10.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.379 -0.373 . . . . 74.31 111.093 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.1 mm -62.68 -34.47 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 123.932 0.77 . . . . 73.54 111.181 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -74.18 -33.43 63.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 122.749 0.419 . . . . 73.24 111.884 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.491 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 49.6 mt-10 -73.78 -37.99 64.81 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.471 -0.331 . . . . 72.41 111.181 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.7 p -74.29 -27.21 60.63 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.049 -0.523 . . . . 64.21 112.088 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.467 ' O ' HG12 ' A' ' 14' ' ' ILE . 23.9 t-20 -67.77 -37.56 82.25 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.935 0.494 . . . . 74.21 110.914 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.465 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 17.7 tp -63.4 -37.9 89.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.449 0.7 . . . . 74.13 111.228 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 57.4 mt -68.28 -35.99 78.69 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.404 -0.816 . . . . 63.13 110.595 174.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -70.22 -24.22 63.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.975 0.91 . . . . 60.4 112.303 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 10' ' ' ASN . 40.6 mm -61.14 -45.26 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.023 0.529 . . . . 73.35 110.049 175.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -104.64 -76.0 0.61 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.72 -0.673 . . . . 75.53 111.171 -172.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 65.1 t30 53.4 76.16 0.22 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.257 1.423 . . . . 72.41 112.284 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -153.51 128.74 9.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.208 -0.906 . . . . 62.31 110.216 -177.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.92 37.68 92.35 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 124.057 0.848 . . . . 65.32 114.44 172.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.54 -143.94 37.91 Favored Glycine 0 C--N 1.335 0.527 0 N-CA-C 111.947 -0.461 . . . . 73.13 111.947 -176.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.509 ' HB2' HD11 ' A' ' 49' ' ' ILE . 1.2 pptp? -92.77 -14.84 27.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.554 -0.535 . . . . 74.3 109.554 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -67.92 -52.64 33.92 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.051 -0.977 . . . . 72.21 110.081 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.77 -27.92 73.49 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.269 -0.878 . . . . 74.0 112.75 174.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -60.02 -42.77 95.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.845 0.323 . . . . 65.31 110.937 172.189 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.858 ' HG2' HD23 ' A' ' 46' ' ' LEU . 51.9 mtt -68.92 -37.55 79.0 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.252 0.345 . . . . 72.21 111.711 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -67.05 -39.88 87.01 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.559 0.537 . . . . 74.2 111.742 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -76.33 -32.88 58.94 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 112.306 0.484 . . . . 75.3 112.306 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 31.7 mt -71.36 -44.99 71.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-O 119.271 -0.395 . . . . 75.33 111.29 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.479 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 m-80 -67.65 -33.84 75.75 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.262 0.467 . . . . 75.4 112.262 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.8 -31.64 64.99 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.256 0.348 . . . . 74.22 111.523 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.739 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.35 20.26 19.17 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 112.907 0.706 . . . . 74.41 112.907 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.479 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 80.0 mt -55.9 -47.68 98.25 Favored Pre-proline 0 CA--C 1.555 1.139 0 N-CA-C 113.286 0.847 . . . . 73.5 113.286 175.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.55 3.6 7.6 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.164 1.451 . . . . 72.13 114.245 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.739 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.7 m-85 -103.41 -29.6 11.1 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.705 0.288 . . . . 73.03 110.765 -178.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.3 ptp -81.9 170.63 15.41 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.885 -0.783 . . . . 73.31 108.885 169.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.09 155.11 40.26 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.205 0.316 . . . . 64.52 110.451 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -68.03 -32.75 73.34 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 111.99 0.367 . . . . 73.03 111.99 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.79 -36.09 72.87 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.184 0.516 . . . . 65.44 111.091 175.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 6.5 tpt -72.52 -26.96 61.96 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.956 -1.02 . . . . 72.03 110.881 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -73.38 -39.33 65.2 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.237 1.015 . . . . 74.54 111.371 178.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.18 -35.29 79.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.475 -0.33 . . . . 74.13 111.188 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.61 -40.17 76.76 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.646 -0.706 . . . . 71.32 110.82 173.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.556 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -58.86 -45.24 90.58 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 124.078 0.951 . . . . 62.1 113.47 -175.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -67.37 -28.97 68.39 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.569 0.543 . . . . 75.54 111.828 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 78.5 mtp180 -78.95 -33.77 44.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.355 -0.384 . . . . 70.11 111.544 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.42 ' O ' HG12 ' A' ' 49' ' ' ILE . 17.7 m -73.82 -27.24 61.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 122.781 0.433 . . . . 75.21 110.46 175.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.858 HD23 ' HG2' ' A' ' 24' ' ' MET . 38.8 mt -68.72 -30.81 69.53 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 111.406 0.15 . . . . 75.45 111.406 172.137 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.15 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 120.852 0.358 . . . . 74.54 111.407 173.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 74.3 mmtt -78.33 -48.51 15.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 115.938 -0.573 . . . . 75.31 110.261 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.509 HD11 ' HB2' ' A' ' 20' ' ' LYS . 16.0 pt -81.97 -13.3 12.4 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 N-CA-C 113.21 0.818 . . . . 73.22 113.21 -176.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -43.06 -48.36 14.85 Favored Pre-proline 0 N--CA 1.486 1.36 0 N-CA-C 116.338 1.977 . . . . 73.04 116.338 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -82.59 27.62 0.6 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 CA-C-N 122.301 1.857 . . . . 74.31 115.386 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.9 mt -102.11 143.55 31.8 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.78 0.8 . . . . 74.21 111.887 177.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.609 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 22.7 m -101.62 26.31 7.49 Favored 'General case' 0 CA--C 1.56 1.363 0 CA-C-N 114.023 -1.444 . . . . 70.23 110.854 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 77.86 -51.26 0.51 Allowed 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 125.995 1.718 . . . . 74.01 112.652 173.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -70.11 -31.27 68.75 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.701 0.8 . . . . 53.24 110.986 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.609 ' OE1' ' HB ' ' A' ' 53' ' ' THR . 26.4 mp0 -67.53 -35.52 79.25 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.898 -0.592 . . . . 72.23 111.011 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -75.04 -27.25 59.97 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-N 115.807 -0.633 . . . . 75.4 110.335 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.07 -22.73 60.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 117.877 0.308 . . . . 73.11 111.461 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -79.17 -31.21 43.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.957 0.503 . . . . 73.53 111.634 175.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.7 mt -89.14 -51.66 5.47 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.565 -0.289 . . . . 63.15 110.586 -178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.68 -121.71 1.83 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.226 1.81 . . . . 73.44 111.878 178.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 24.3 mm -95.88 100.48 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.401 -1.333 . . . . 74.22 107.401 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -92.06 -26.32 18.37 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.677 -0.692 . . . . 75.51 112.112 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -139.77 88.07 2.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.536 0.684 . . . . 75.03 111.872 -179.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.485 0 CA-C-O 121.51 0.671 . . . . 74.24 110.51 175.107 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.436 HD22 HG21 ' A' ' 45' ' ' THR . 74.8 mt . . . . . 0 CA--C 1.514 -0.424 0 CA-C-O 120.927 0.394 . . . . 74.31 110.142 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.2 166.97 20.9 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.227 -0.897 . . . . 73.44 109.848 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.5 mm -67.94 -24.13 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.17 0.588 . . . . 71.4 111.982 -174.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.23 -34.42 65.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.862 -0.608 . . . . 71.52 110.676 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 40.6 mt-10 -73.51 -37.14 65.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.454 0.471 . . . . 71.24 111.357 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -73.21 -27.66 61.74 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.496 0.498 . . . . 74.32 111.687 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.444 ' O ' HG12 ' A' ' 14' ' ' ILE . 9.0 t-20 -64.48 -40.07 94.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.003 0.521 . . . . 71.43 111.046 171.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.601 HD23 ' HA ' ' A' ' 42' ' ' ALA . 16.7 tp -60.7 -34.34 74.22 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.067 0.947 . . . . 73.32 111.561 175.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.706 HD22 HD23 ' A' ' 23' ' ' LEU . 40.0 mt -71.07 -35.81 72.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.627 -0.715 . . . . 71.24 110.572 178.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.603 ' HA ' HD11 ' A' ' 62' ' ' ILE . 17.1 t -71.23 -23.75 62.06 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.32 -0.854 . . . . 74.11 112.902 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 10' ' ' ASN . 27.8 mm -61.87 -45.78 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.883 0.473 . . . . 75.15 110.142 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -106.33 -84.16 0.51 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.612 -0.709 . . . . 74.54 111.265 -174.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.401 ' H ' HD11 ' A' ' 23' ' ' LEU . 65.0 t30 46.58 87.02 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.238 1.415 . . . . 74.43 112.894 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -93.17 -83.98 0.3 Allowed 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.027 -0.421 . . . . 74.43 110.575 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -120.13 83.81 0.36 Allowed Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 109.987 -1.245 . . . . 73.43 109.987 177.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.07 -134.94 20.67 Favored Glycine 0 N--CA 1.449 -0.46 0 O-C-N 124.395 0.703 . . . . 44.31 111.422 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.404 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 3.0 pptp? -97.91 -22.03 16.56 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 123.8 0.353 . . . . 74.3 111.157 178.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HB2' ' OE1' ' A' ' 54' ' ' GLU . 53.3 ttp180 -70.23 -51.04 33.77 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.568 0.543 . . . . 74.12 110.33 -178.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.33 -29.18 71.95 Favored Glycine 0 C--O 1.223 -0.571 0 O-C-N 124.183 0.927 . . . . 55.44 112.592 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.706 HD23 HD22 ' A' ' 12' ' ' LEU . 26.8 tp -63.14 -41.86 99.38 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.264 0.625 . . . . 72.42 110.97 172.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.763 ' HG2' HD23 ' A' ' 46' ' ' LEU . 58.0 mtt -67.42 -37.91 83.77 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 122.979 0.512 . . . . 74.13 111.64 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 49.0 mm-40 -67.09 -37.8 84.58 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 123.411 0.445 . . . . 74.42 110.978 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -71.27 -33.89 70.19 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 112.388 0.514 . . . . 74.1 112.388 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.9 mt -71.56 -46.56 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 123.183 0.302 . . . . 64.13 111.049 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -71.95 -31.23 66.11 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.053 0.761 . . . . 65.25 113.053 -176.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.87 -30.37 50.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.541 0.2 . . . . 74.34 111.541 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.747 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.68 18.42 19.35 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.448 0.536 . . . . 71.33 112.448 -178.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 71.9 mt -57.81 -46.34 99.74 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 113.521 0.934 . . . . 74.45 113.521 171.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -67.96 -18.26 46.47 Favored 'Trans proline' 0 C--N 1.383 2.353 0 CA-C-N 121.666 1.631 . . . . 73.4 113.399 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.747 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 90.7 m-85 -90.44 -32.78 16.25 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 122.376 0.27 . . . . 75.22 111.574 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptp -81.6 168.9 17.69 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.608 0.242 . . . . 73.34 110.761 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.55 171.81 14.57 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.961 -0.563 . . . . 73.34 112.029 -177.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -36.85 85.44 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.57 -0.741 . . . . 64.52 112.936 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.22 -35.84 66.37 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.394 0.434 . . . . 73.14 110.753 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 50.6 ttm -73.99 -30.48 62.5 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.45 0.469 . . . . 74.33 111.065 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.4 mtm-85 -68.8 -41.56 78.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.766 0.284 . . . . 74.23 111.766 174.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.09 -47.68 85.2 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 123.838 0.711 . . . . 73.21 111.065 175.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.5 tp -61.49 -41.93 98.02 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 124.568 1.168 . . . . 74.42 111.58 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.601 ' HA ' HD23 ' A' ' 11' ' ' LEU . . . -55.73 -43.91 77.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.514 1.134 . . . . 74.41 113.468 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -64.12 -36.16 83.13 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.888 0.742 . . . . 75.42 112.441 -176.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -80.12 -34.86 37.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.406 -0.361 . . . . 75.51 111.964 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.436 HG21 HD22 ' A' ' 4' ' ' LEU . 13.7 m -72.28 -39.93 67.98 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.645 0.378 . . . . 65.43 111.618 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.763 HD23 ' HG2' ' A' ' 24' ' ' MET . 63.9 mt -65.93 -29.0 69.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.194 0.442 . . . . 74.42 112.194 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.13 -23.02 63.92 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 123.508 0.505 . . . . 53.01 112.189 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -87.49 -27.82 22.42 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 122.43 0.292 . . . . 73.35 111.665 -178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.546 HG22 HD13 ' A' ' 52' ' ' LEU . 9.9 mt -98.11 -12.39 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 121.144 0.497 . . . . 73.12 110.691 -176.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.01 99.31 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 114.456 1.28 . . . . 63.12 114.456 173.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.99 -12.56 26.04 Favored 'Trans proline' 0 C--N 1.385 2.486 0 CA-C-N 121.863 1.701 . . . . 74.34 114.414 174.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.546 HD13 HG22 ' A' ' 49' ' ' ILE . 72.6 mt -83.46 139.32 33.01 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.625 -0.509 . . . . 75.5 109.625 -176.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.4 t -82.8 168.41 17.18 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 120.857 -0.337 . . . . 75.23 110.252 179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.454 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 4.9 tp10 -64.13 -40.34 95.96 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.931 0.892 . . . . 74.41 111.404 -174.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -74.59 -29.73 61.43 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.862 -0.608 . . . . 70.43 111.597 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -72.11 -36.25 69.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.224 -0.443 . . . . 73.13 111.324 178.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -74.33 -23.16 59.01 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.318 -0.401 . . . . 72.34 110.744 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.71 -24.71 67.05 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.964 0.357 . . . . 72.25 111.964 174.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -76.17 -25.86 55.64 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.93 0.492 . . . . 75.32 111.588 175.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 29.6 mt -93.29 -53.56 4.05 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.258 -0.428 . . . . 74.43 110.42 -175.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 63.92 -85.03 0.02 OUTLIER 'General case' 0 C--N 1.351 0.645 0 C-N-CA 126.477 1.911 . . . . 73.3 112.603 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.603 HD11 ' HA ' ' A' ' 13' ' ' SER . 49.5 mm -120.12 -44.79 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 108.838 -0.801 . . . . 74.41 108.838 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 72.12 -79.83 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.117 1.767 . . . . 74.51 112.669 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.08 69.22 1.48 Allowed 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 121.202 0.525 . . . . 73.11 112.147 -172.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.535 0 CA-C-O 121.304 0.574 . . . . 62.4 111.237 176.245 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.3 mt . . . . . 0 C--O 1.239 0.509 0 N-CA-C 109.22 -0.659 . . . . 75.04 109.22 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 14.8 t -72.82 156.09 39.26 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.905 -0.776 . . . . 72.11 108.905 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 48.0 mt -62.39 -27.26 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 123.853 0.861 . . . . 64.54 111.505 -173.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -73.12 -35.07 66.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.909 0.483 . . . . 63.05 111.877 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -73.18 -35.42 66.39 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.262 0.225 . . . . 50.03 110.977 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.588 HG21 ' H ' ' A' ' 64' ' ' ALA . 5.7 m -73.5 -28.95 62.18 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.852 0.72 . . . . 72.03 110.596 178.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.404 ' O ' HG13 ' A' ' 14' ' ' ILE . 55.0 t30 -66.15 -39.69 90.0 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.904 -0.589 . . . . 71.41 110.879 170.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.445 HD11 ' HG3' ' A' ' 38' ' ' MET . 62.8 tp -67.05 -34.3 77.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.838 0.455 . . . . 70.24 111.064 177.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.628 HD13 ' HE1' ' A' ' 57' ' ' TYR . 72.4 mt -67.97 -32.86 73.57 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.585 -0.734 . . . . 73.42 111.088 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -72.01 -37.28 69.82 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.485 0.714 . . . . 74.51 112.484 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 10' ' ' ASN . 90.3 mt -69.07 -45.48 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-O 120.968 0.414 . . . . 63.4 110.808 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -102.02 28.08 6.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.125 -0.489 . . . . 72.44 111.545 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.42 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 12.9 t-20 -73.27 100.3 3.1 Favored 'General case' 0 C--N 1.344 0.339 0 O-C-N 123.606 0.567 . . . . 75.22 110.247 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -113.84 -69.25 0.87 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.344 -0.844 . . . . 71.33 111.479 -174.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -146.56 64.0 0.44 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.893 -0.67 . . . . 45.44 111.869 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.19 -157.41 40.85 Favored Glycine 0 C--O 1.225 -0.42 0 C-N-CA 121.443 -0.408 . . . . 51.32 112.1 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -69.53 -33.9 73.47 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 122.595 0.358 . . . . 75.4 111.495 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.519 ' HA ' ' HD3' ' A' ' 21' ' ' ARG . 12.3 mmt180 -73.45 -43.46 60.25 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-O 118.803 -0.618 . . . . 72.3 112.133 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.82 -27.72 71.58 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 120.982 -0.628 . . . . 54.13 112.905 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.3 mm? -67.56 -54.49 19.47 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 122.843 0.457 . . . . 72.42 111.27 170.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.745 ' HG2' HD22 ' A' ' 46' ' ' LEU . 30.8 mtt -64.45 -44.46 91.02 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.014 0.746 . . . . 75.15 113.014 -174.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 18.1 mm-40 -68.9 -36.6 78.22 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 122.71 0.404 . . . . 71.23 111.795 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -70.91 -46.28 62.8 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.955 -0.387 . . . . 75.43 109.955 177.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.55 HG23 ' HE3' ' A' ' 34' ' ' MET . 34.5 mt -62.29 -41.96 93.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.32 0.648 . . . . 74.55 112.338 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.14 -42.82 95.69 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.308 0.643 . . . . 74.21 112.183 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -27.34 36.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 74.43 112.073 -177.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.746 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -97.48 11.39 36.95 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 113.173 0.805 . . . . 74.31 113.173 -174.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 55.4 mt -57.9 -45.88 99.76 Favored Pre-proline 0 CA--C 1.557 1.215 0 N-CA-C 114.458 1.281 . . . . 73.0 114.458 177.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.3 -12.21 31.47 Favored 'Trans proline' 0 C--N 1.384 2.401 0 C-N-CA 121.815 1.677 . . . . 75.31 113.999 173.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.746 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 74.3 m-85 -96.77 -7.84 32.75 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.36 0.264 . . . . 75.51 111.24 -178.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.55 ' HE3' HG23 ' A' ' 27' ' ' ILE . 64.3 mtt -83.05 154.91 24.18 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.317 0.58 . . . . 74.33 111.846 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.74 158.93 35.23 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 114.386 -1.279 . . . . 64.21 109.048 171.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -47.69 -38.94 16.16 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.753 1.221 . . . . 74.32 113.819 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.18 -51.69 42.87 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 123.352 0.407 . . . . 75.13 111.697 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' MET . . . . . 0.445 ' HG3' HD11 ' A' ' 11' ' ' LEU . 0.5 OUTLIER -73.74 -28.23 61.58 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.867 0.691 . . . . 74.0 112.867 -173.672 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -68.03 -55.72 11.55 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 123.686 0.794 . . . . 75.33 111.566 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -70.73 -29.23 65.44 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.855 0.687 . . . . 71.32 112.855 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.2 tp -63.8 -38.91 92.86 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 123.734 0.646 . . . . 75.42 110.7 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.467 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -60.86 -37.05 80.76 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 113.711 1.004 . . . . 75.21 113.711 -175.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.62 -37.12 86.47 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.39 0.431 . . . . 64.23 110.743 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -80.07 -31.75 39.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.666 -0.697 . . . . 75.25 111.327 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.1 m -69.66 -43.11 73.24 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 122.856 0.463 . . . . 53.21 110.355 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.745 HD22 ' HG2' ' A' ' 24' ' ' MET . 85.9 mt -68.75 -29.39 67.78 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.654 -0.703 . . . . 73.22 111.731 178.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.79 -24.15 61.69 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 123.438 0.461 . . . . 75.41 111.474 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -87.52 -33.03 19.1 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.347 0.499 . . . . 72.41 112.347 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.48 HG13 ' HE2' ' A' ' 24' ' ' MET . 34.8 pt -90.92 -13.93 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 112.894 0.702 . . . . 71.15 112.894 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -49.78 91.9 Favored Pre-proline 0 N--CA 1.48 1.067 0 CA-C-O 117.797 -1.097 . . . . 64.55 113.619 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -73.87 -10.73 23.37 Favored 'Trans proline' 0 C--N 1.384 2.435 0 C-N-CA 121.708 1.605 . . . . 75.44 113.213 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.521 HD23 ' HG2' ' A' ' 56' ' ' GLU . 78.0 mt -81.55 148.5 29.11 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.667 -0.494 . . . . 74.31 109.667 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.489 HG21 ' H ' ' A' ' 56' ' ' GLU . 7.1 t -77.95 167.52 21.35 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.399 -0.593 . . . . 65.2 109.399 170.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -66.79 -31.76 72.6 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.886 0.474 . . . . 74.41 110.415 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -73.31 -29.71 62.88 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.36 -0.837 . . . . 75.22 111.008 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.521 ' HG2' HD23 ' A' ' 52' ' ' LEU . 4.9 tp10 -66.73 -46.42 75.53 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.861 0.464 . . . . 75.44 109.793 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.628 ' HE1' HD13 ' A' ' 12' ' ' LEU . 76.0 t80 -67.36 -29.09 68.54 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 123.774 0.671 . . . . 62.45 111.552 177.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.64 -33.45 72.8 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.422 0.527 . . . . 75.41 112.422 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -80.51 -29.5 37.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.319 -0.4 . . . . 75.42 111.514 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.0 mt -104.01 16.7 25.7 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.705 0.631 . . . . 73.42 112.705 -171.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.75 -69.97 0.1 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 73.55 113.294 -169.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mp -121.68 89.55 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 107.227 -1.398 . . . . 71.4 107.227 169.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -90.02 -64.98 1.06 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.997 -1.456 . . . . 72.14 109.945 -178.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.588 ' H ' HG21 ' A' ' 9' ' ' THR . . . -121.35 96.34 5.05 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.37 -0.377 . . . . 75.32 110.853 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.61 0 CA-C-O 120.904 0.383 . . . . 73.0 110.546 175.031 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt . . . . . 0 CA--C 1.517 -0.29 0 CA-C-O 120.474 0.178 . . . . 73.43 110.694 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.1 t -88.56 170.69 10.65 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.014 -0.736 . . . . 70.23 109.014 173.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -66.79 -30.97 51.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.039 0.535 . . . . 74.14 111.185 -172.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.74 -49.82 73.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.252 0.621 . . . . 65.23 111.708 177.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -66.06 -39.27 89.95 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.429 0.691 . . . . 75.11 111.864 -175.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.401 ' HA ' HD11 ' A' ' 12' ' ' LEU . 3.8 p -74.63 -26.34 59.82 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.855 0.687 . . . . 71.12 112.855 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -67.76 -32.48 73.11 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.052 0.541 . . . . 72.23 110.919 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.484 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 16.6 tp -64.55 -39.58 94.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.409 0.684 . . . . 73.11 111.048 172.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' ' 9' ' ' THR . 55.4 mt -69.53 -32.14 70.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.381 -0.827 . . . . 74.4 111.037 178.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.556 ' HA ' HD11 ' A' ' 62' ' ' ILE . 22.6 t -69.37 -24.85 63.93 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 73.12 111.867 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.8 mt -67.19 -44.27 87.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 122.691 0.396 . . . . 74.35 110.341 174.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.439 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 95.5 m-85 -95.98 -86.84 0.3 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.313 0.486 . . . . 75.3 112.313 -175.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.533 ' HA ' HD23 ' A' ' 23' ' ' LEU . 13.4 t-20 53.87 85.32 0.05 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.905 1.282 . . . . 75.31 112.041 -171.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -88.82 -81.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.182 -0.463 . . . . 74.41 111.104 -177.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -163.52 53.6 0.29 Allowed Glycine 0 CA--C 1.499 -0.937 0 N-CA-C 110.5 -1.04 . . . . 73.1 110.5 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.83 -175.28 16.24 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.729 -0.948 . . . . 65.52 110.729 -175.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HD3' HG23 ' A' ' 49' ' ' ILE . 3.0 pptp? -83.92 -18.54 37.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.696 0.248 . . . . 72.1 111.565 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 22.5 ttm180 -65.25 -52.18 56.09 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 123.824 0.702 . . . . 74.01 109.319 172.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.76 -29.6 75.46 Favored Glycine 0 N--CA 1.449 -0.467 0 O-C-N 124.516 1.135 . . . . 54.54 113.378 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.533 HD23 ' HA ' ' A' ' 16' ' ' ASN . 1.3 mm? -64.07 -42.31 97.02 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 116.901 0.351 . . . . 72.42 110.925 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.631 ' HG2' HD23 ' A' ' 46' ' ' LEU . 64.0 mtt -69.07 -41.19 77.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.848 0.314 . . . . 74.23 111.848 178.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 7.5 mm-40 -65.01 -36.24 83.76 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.61 0.243 . . . . 74.3 111.48 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.439 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.9 m-80 -78.85 -44.1 23.66 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 112.56 0.578 . . . . 72.35 112.56 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.407 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 52.6 mt -64.55 -51.34 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 119.17 -0.443 . . . . 73.22 111.837 -178.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -62.41 -37.52 86.11 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.145 0.794 . . . . 62.41 113.145 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.69 -30.13 27.02 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.491 0.552 . . . . 72.43 112.491 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.515 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -104.47 19.54 20.12 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.229 0.455 . . . . 71.44 112.229 -175.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 89.5 mt -55.05 -45.36 99.85 Favored Pre-proline 0 CA--C 1.559 1.292 0 N-CA-C 113.629 0.974 . . . . 74.15 113.629 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -67.89 -13.55 38.79 Favored 'Trans proline' 0 C--N 1.394 2.952 0 C-N-CA 122.063 1.842 . . . . 74.35 114.094 174.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.515 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.9 m-85 -92.03 -10.44 39.19 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.517 0.198 . . . . 75.34 111.158 178.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.0 mtm -99.95 -177.97 3.71 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.34 0.59 . . . . 71.33 111.902 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.37 159.86 28.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.03 -0.987 . . . . 74.43 110.23 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.57 -36.59 83.02 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.203 0.601 . . . . 52.4 111.596 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.45 -35.93 73.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.078 0.466 . . . . 65.21 110.254 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -25.98 61.33 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.456 -0.793 . . . . 72.14 111.839 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 -68.82 -41.83 78.07 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.117 0.567 . . . . 71.11 110.838 177.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -73.04 -31.74 64.63 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.324 -0.398 . . . . 74.24 111.652 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 42.9 tp -68.17 -34.66 76.71 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.046 -0.525 . . . . 74.54 111.062 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.484 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -59.0 -41.37 87.49 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 123.625 0.77 . . . . 61.15 112.566 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -66.47 -35.26 79.83 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 123.828 0.705 . . . . 74.43 111.493 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -69.88 -42.82 72.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.963 -0.562 . . . . 73.24 111.447 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.0 m -72.53 -36.75 68.38 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.684 0.615 . . . . 73.22 111.195 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.631 HD23 ' HG2' ' A' ' 24' ' ' MET . 82.5 mt -67.37 -28.32 67.85 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.196 0.443 . . . . 72.42 112.196 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.9 61.35 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.762 0.315 . . . . 73.03 111.534 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -83.7 -32.91 25.3 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.963 0.505 . . . . 74.42 111.315 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.695 HG22 HD11 ' A' ' 52' ' ' LEU . 7.3 mt -94.54 -10.86 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 121.245 0.545 . . . . 73.14 110.797 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.65 -45.77 99.91 Favored Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 114.509 1.3 . . . . 61.4 114.509 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -77.63 -1.88 12.04 Favored 'Trans proline' 0 C--N 1.388 2.61 0 CA-C-N 121.854 1.698 . . . . 73.33 113.605 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.695 HD11 HG22 ' A' ' 49' ' ' ILE . 57.7 mt -86.56 140.79 29.55 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.061 -0.718 . . . . 71.32 109.061 174.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 t -84.22 170.37 13.81 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 108.521 -0.918 . . . . 74.01 108.521 168.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.453 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 15.0 tp10 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.687 0.795 . . . . 64.13 112.88 -166.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -75.29 -28.2 59.64 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.216 -0.902 . . . . 75.54 112.497 -173.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.65 -52.18 66.63 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.573 0.546 . . . . 71.34 112.273 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -69.12 -24.75 64.15 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.624 0.578 . . . . 72.41 111.841 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.4 -29.45 70.51 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 111.798 0.296 . . . . 73.32 111.798 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -81.99 -15.03 55.1 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.589 0.589 . . . . 74.54 112.589 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.35 -52.21 6.37 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.363 -0.21 . . . . 73.42 110.675 175.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 57.66 -101.05 0.12 Allowed 'General case' 0 C--N 1.354 0.796 0 O-C-N 125.168 1.542 . . . . 62.24 111.457 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.556 HD11 ' HA ' ' A' ' 13' ' ' SER . 40.1 mm -113.89 90.94 1.61 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 107.635 -1.246 . . . . 74.25 107.635 169.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -96.28 105.27 17.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.916 -0.772 . . . . 74.42 108.916 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 70.66 -166.13 0.15 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 125.4 1.48 . . . . 72.34 109.995 -166.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.685 0 C-N-CA 126.121 1.768 . . . . 63.12 114.866 173.197 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 70.9 mt . . . . . 0 C--O 1.238 0.461 0 N-CA-C 110.256 -0.276 . . . . 75.21 110.256 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.9 t -84.3 170.24 13.87 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.602 -0.518 . . . . 75.41 109.602 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.63 -33.71 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.656 0.782 . . . . 71.41 111.014 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.41 -34.82 65.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.259 0.466 . . . . 73.34 112.259 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 53.8 mt-10 -70.15 -39.59 75.28 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.419 0.155 . . . . 64.43 111.419 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.433 HG23 ' H ' ' A' ' 64' ' ' ALA . 2.5 m -73.91 -28.03 61.33 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 123.562 0.539 . . . . 72.24 110.815 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -65.62 -41.61 92.51 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.949 0.5 . . . . 74.33 110.334 174.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.472 HD22 ' HA ' ' A' ' 42' ' ' ALA . 51.4 tp -68.15 -34.6 76.64 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.244 -0.889 . . . . 75.31 111.256 177.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 91.5 mt -65.1 -36.02 82.96 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 115.656 -0.702 . . . . 70.11 111.656 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.1 m -65.62 -28.28 69.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 123.811 0.694 . . . . 75.31 112.148 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 55.4 mt -71.39 -37.78 66.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.003 0.521 . . . . 73.22 110.945 -177.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -119.11 27.33 8.91 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.742 0.275 . . . . 73.5 111.742 -174.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.529 ' HA ' HD21 ' A' ' 23' ' ' LEU . 9.7 t30 -76.94 101.21 5.87 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.058 -0.519 . . . . 71.22 111.736 -172.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -118.66 -117.88 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.488 -0.778 . . . . 75.11 112.249 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -96.64 87.83 0.96 Allowed Glycine 0 C--N 1.341 0.84 0 C-N-CA 121.325 -0.464 . . . . 63.21 112.985 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.28 -150.91 46.16 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 111.645 -0.582 . . . . 61.31 111.645 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.619 ' HG2' ' HB3' ' A' ' 54' ' ' GLU . 4.7 pttp -85.38 -17.39 36.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.751 -0.38 . . . . 72.24 110.431 175.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -67.45 -48.84 66.07 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.894 -0.593 . . . . 73.13 109.942 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.35 -33.08 86.29 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 123.89 0.744 . . . . 72.35 113.342 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.529 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.9 mm? -64.8 -51.78 60.38 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.9 0.35 . . . . 73.51 111.894 176.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.5 mtp -70.77 -34.6 71.98 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.457 0.473 . . . . 74.23 111.648 -173.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -66.45 -43.85 84.42 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 111.974 0.361 . . . . 74.13 111.974 175.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -69.4 -40.87 77.08 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 112.523 0.564 . . . . 75.32 112.523 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.473 ' CG2' ' HB1' ' A' ' 42' ' ' ALA . 63.8 mt -65.89 -44.75 92.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 119.149 -0.453 . . . . 61.24 111.426 -177.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.437 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 49.2 m-80 -70.12 -25.78 63.65 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.562 0.579 . . . . 70.44 112.562 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.86 -27.97 33.23 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 111.655 0.243 . . . . 74.1 111.655 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -98.28 7.65 45.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.934 0.346 . . . . 73.44 111.934 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 89.2 mt -58.55 -45.38 99.67 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-O 118.3 -0.857 . . . . 71.13 112.955 173.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -64.0 -5.77 9.89 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 122.567 2.178 . . . . 54.02 114.598 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -108.23 -134.56 0.34 Allowed 'General case' 0 C--O 1.242 0.665 0 N-CA-C 108.172 -1.047 . . . . 64.11 108.172 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtt 61.11 -105.44 0.2 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.784 1.234 . . . . 74.41 110.875 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -159.19 -69.08 0.08 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.933 0.893 . . . . 74.53 109.355 172.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 176.01 -40.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.478 1.511 . . . . 73.42 108.507 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.22 -50.39 63.96 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.864 -1.062 . . . . 74.2 110.222 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 42.9 mtp -64.37 -27.9 69.33 Favored 'General case' 0 C--O 1.209 -1.066 0 O-C-N 123.839 0.712 . . . . 73.52 112.212 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -73.73 -49.76 24.04 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.448 0.468 . . . . 73.11 111.705 -176.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -72.47 -32.0 65.88 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.85 0.315 . . . . 73.42 111.85 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.4 tp -69.12 -33.62 73.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.087 -0.506 . . . . 51.12 110.7 174.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -66.37 -31.67 72.58 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-N 116.006 -0.543 . . . . 63.2 112.084 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -70.38 -31.49 68.75 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.623 0.577 . . . . 75.02 111.381 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -71.05 -38.69 72.53 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.284 0.365 . . . . 75.41 111.55 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.49 ' O ' HG13 ' A' ' 49' ' ' ILE . 13.8 m -73.56 -33.92 64.92 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 123.537 0.523 . . . . 70.45 111.227 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 90.1 mt -67.09 -31.92 72.73 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.547 0.339 . . . . 71.32 111.638 174.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.52 -20.34 62.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 123.582 0.551 . . . . 71.35 111.635 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.22 -40.66 23.48 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.621 -0.263 . . . . 74.22 111.091 176.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 45' ' ' THR . 2.0 mt -89.73 -15.86 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 112.215 0.45 . . . . 73.42 112.215 -172.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -47.51 98.57 Favored Pre-proline 0 CA--C 1.555 1.17 0 N-CA-C 114.13 1.159 . . . . 71.14 114.13 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.21 0.97 9.32 Favored 'Trans proline' 0 C--N 1.378 2.107 0 CA-C-N 121.855 1.698 . . . . 72.04 113.789 174.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.47 HD13 ' HA ' ' A' ' 49' ' ' ILE . 88.0 mt -87.23 158.08 19.18 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.033 0.444 . . . . 64.31 110.367 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.572 HG23 ' H ' ' A' ' 56' ' ' GLU . 7.5 t -102.02 158.49 16.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.748 -0.834 . . . . 74.14 108.748 169.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.619 ' HB3' ' HG2' ' A' ' 20' ' ' LYS . 4.8 pt-20 -87.2 -4.4 59.1 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.719 0.295 . . . . 74.32 111.064 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.04 -45.44 70.44 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.563 -0.744 . . . . 72.13 109.516 166.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.572 ' H ' HG23 ' A' ' 53' ' ' THR . 29.8 tt0 -76.93 -34.35 57.67 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.889 -0.596 . . . . 74.15 110.854 177.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -67.4 -25.08 65.77 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 123.271 0.357 . . . . 74.15 110.998 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.05 -37.99 81.97 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.094 -0.379 . . . . 71.42 111.246 174.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -79.87 -19.94 47.08 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.386 0.513 . . . . 73.44 112.386 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 83.3 mt -84.06 -68.23 0.73 Allowed 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.854 -0.424 . . . . 74.32 109.854 173.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.82 -127.7 2.36 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 125.525 1.53 . . . . 64.23 111.452 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 39.4 mm -99.34 95.34 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 107.974 -1.121 . . . . 75.12 107.974 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -106.34 -7.44 17.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.278 -0.874 . . . . 75.3 111.303 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.433 ' H ' HG23 ' A' ' 9' ' ' THR . . . -137.12 -172.84 3.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.677 -0.861 . . . . 72.45 108.677 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.329 0 C-N-CA 124.854 1.262 . . . . 72.23 111.802 -175.467 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.466 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 5.1 mp . . . . . 0 C--O 1.238 0.485 0 N-CA-C 107.723 -1.214 . . . . 72.12 107.723 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.692 HG22 ' HG3' ' A' ' 8' ' ' GLU . 4.2 t -76.14 171.54 14.33 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 109.472 -0.566 . . . . 75.13 109.472 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 9.1 mm -61.78 -36.67 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.142 0.577 . . . . 74.44 111.859 -170.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.02 -24.9 59.62 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.172 0.805 . . . . 72.42 113.172 176.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.692 ' HG3' HG22 ' A' ' 5' ' ' THR . 46.7 mt-10 -75.42 -38.78 59.62 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 117.762 0.256 . . . . 75.55 111.053 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.12 -28.68 62.4 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.464 0.478 . . . . 74.3 111.871 174.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.451 ' O ' HG13 ' A' ' 14' ' ' ILE . 14.5 t-20 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.472 0.482 . . . . 73.45 110.652 170.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.452 ' HA ' HD11 ' A' ' 14' ' ' ILE . 49.2 tp -64.74 -33.6 76.35 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 124.028 0.83 . . . . 74.4 111.646 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.58 ' HA ' HD12 ' A' ' 23' ' ' LEU . 81.1 mt -59.59 -47.74 84.38 Favored 'General case' 0 C--O 1.214 -0.812 0 O-C-N 124.032 0.833 . . . . 64.3 111.731 175.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 46.2 p -71.55 -23.2 61.72 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.711 0.634 . . . . 73.22 112.711 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.452 HD11 ' HA ' ' A' ' 11' ' ' LEU . 87.9 mt -64.73 -51.52 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 122.766 0.426 . . . . 72.5 111.278 175.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.524 ' HB2' HD13 ' A' ' 23' ' ' LEU . 68.9 m-85 -106.3 29.8 6.51 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.057 0.392 . . . . 75.42 112.057 -174.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 14.7 t-20 -84.09 102.45 12.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.247 -0.433 . . . . 63.54 111.415 -176.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -123.22 -26.7 4.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.855 -0.611 . . . . 73.41 111.74 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.12 69.5 0.17 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.698 -0.763 . . . . 64.52 112.055 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.83 -149.28 46.12 Favored Glycine 0 N--CA 1.45 -0.372 0 O-C-N 123.859 0.388 . . . . 64.15 112.439 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.842 ' HE3' ' HA ' ' A' ' 53' ' ' THR . 0.6 OUTLIER -90.4 -11.17 41.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.741 0.305 . . . . 75.23 110.436 178.824 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -65.5 -52.86 49.7 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 123.963 0.905 . . . . 75.3 109.283 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.8 -30.34 74.4 Favored Glycine 0 C--O 1.218 -0.888 0 CA-C-N 114.966 -1.015 . . . . 41.5 112.622 174.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.687 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -62.28 -46.95 86.47 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 117.15 0.475 . . . . 70.3 111.353 175.32 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.604 ' HG2' HD21 ' A' ' 46' ' ' LEU . 46.3 mtt -63.72 -43.77 95.56 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.242 0.617 . . . . 74.34 112.369 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.11 -36.0 64.19 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.584 0.553 . . . . 75.33 112.02 -176.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -74.54 -33.67 62.79 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 119.534 -0.27 . . . . 64.02 111.52 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.479 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 11.9 mt -66.6 -49.73 72.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-O 119.282 -0.39 . . . . 71.04 111.17 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -65.27 -35.59 81.5 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.436 0.532 . . . . 74.44 112.436 -177.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.62 -34.53 58.35 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 111.971 0.359 . . . . 64.14 111.971 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.729 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.11 17.34 21.39 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 112.676 0.621 . . . . 75.01 112.676 -176.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 70.3 mt -57.83 -44.44 99.41 Favored Pre-proline 0 CA--C 1.554 1.134 0 N-CA-C 113.673 0.99 . . . . 74.34 113.673 172.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -69.61 -15.97 37.93 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 121.931 1.754 . . . . 74.01 113.787 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.729 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 99.4 m-85 -92.03 -9.95 40.94 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.566 0.346 . . . . 72.22 111.616 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.527 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 65.7 mtt -85.28 162.77 18.98 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.294 0.569 . . . . 65.43 111.309 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.89 149.98 37.67 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 107.064 -1.458 . . . . 74.11 107.064 160.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.63 -25.13 66.07 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.081 0.771 . . . . 75.3 113.081 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -66.46 -48.53 69.63 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.69 0.618 . . . . 75.11 111.095 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 31.8 ttp -77.42 -24.29 50.44 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.501 -0.772 . . . . 75.51 111.155 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.449 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 57.4 ttt180 -63.52 -53.03 58.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.78 1.232 . . . . 75.13 111.878 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.696 0.398 . . . . 74.23 112.059 174.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.4 tp -61.94 -39.0 90.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 122.524 0.33 . . . . 73.22 110.707 172.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.3 -30.18 70.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.187 0.995 . . . . 72.5 112.329 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 43' ' ' LYS . 14.2 tppt? -65.46 -39.47 92.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.347 -0.842 . . . . 74.34 110.453 175.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 -71.06 -38.56 72.49 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.654 -0.703 . . . . 73.32 111.85 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.466 ' O ' HG13 ' A' ' 49' ' ' ILE . 33.3 m -67.86 -40.4 83.63 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.665 0.603 . . . . 74.2 111.647 -177.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.604 HD21 ' HG2' ' A' ' 24' ' ' MET . 21.4 mt -70.06 -28.76 65.71 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.949 0.351 . . . . 73.44 111.949 178.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.09 -25.57 62.67 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 123.423 0.452 . . . . 72.22 111.427 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -73.72 -49.38 25.89 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 122.433 0.293 . . . . 74.14 111.327 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.501 HD11 HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -95.42 3.45 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 112.285 0.476 . . . . 75.2 112.285 -169.504 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.42 ' HB1' ' HD3' ' A' ' 51' ' ' PRO . . . -52.64 -48.69 89.68 Favored Pre-proline 0 CA--C 1.556 1.206 0 N-CA-C 114.019 1.118 . . . . 72.55 114.019 171.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.42 ' HD3' ' HB1' ' A' ' 50' ' ' ALA . 2.8 Cg_exo -80.59 -3.81 12.63 Favored 'Trans proline' 0 C--N 1.379 2.157 0 CA-C-N 121.917 1.72 . . . . 74.54 113.977 173.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.422 ' HB2' HG21 ' A' ' 49' ' ' ILE . 77.5 mt -104.86 81.72 1.79 Allowed 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.086 0.469 . . . . 75.35 110.195 -177.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.842 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 2.7 t -87.13 87.68 7.51 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.165 0.802 . . . . 74.41 113.165 -173.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.425 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 17.0 mm-40 79.72 -66.15 0.17 Allowed 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.976 1.31 . . . . 75.02 113.395 162.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -70.91 -31.19 67.73 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.475 0.71 . . . . 75.15 110.242 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 1.8 mm-40 -76.52 -28.35 56.33 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.564 -0.744 . . . . 74.54 110.505 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -72.03 -25.54 61.85 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.496 0.718 . . . . 72.15 110.765 174.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.26 -20.69 61.49 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 111.969 0.359 . . . . 74.11 111.969 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.16 -41.61 84.17 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.189 0.519 . . . . 75.55 110.766 168.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.526 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.0 mt -85.93 -61.46 1.75 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.823 -1.08 . . . . 74.12 110.607 -171.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.17 35.34 19.6 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 124.902 1.376 . . . . 73.32 112.772 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp 64.39 104.9 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.948 1.299 . . . . 71.43 110.767 -172.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.526 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 13.2 m-85 -93.21 -60.97 1.66 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.729 -0.669 . . . . 71.42 111.675 177.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -87.27 80.12 8.33 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.865 0.84 . . . . 72.31 112.122 -171.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.101 -0.954 . . . . 61.34 110.657 177.581 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 77.6 mt . . . . . 0 N--CA 1.446 -0.651 0 N-CA-C 110.039 -0.356 . . . . 74.14 110.039 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.09 161.8 29.65 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.512 -0.551 . . . . 73.11 109.512 168.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.41 ' HA ' ' OG1' ' A' ' 9' ' ' THR . 13.5 mm -80.28 -9.26 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.275 0.56 . . . . 75.52 110.908 -175.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.09 -34.78 73.58 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.905 -0.497 . . . . 72.33 110.58 169.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.541 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.2 mm-40 -66.29 -49.14 68.09 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.756 0.66 . . . . 72.02 109.343 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.435 ' HB ' HG21 ' A' ' 62' ' ' ILE . 1.9 p -69.87 -26.89 64.41 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 123.943 0.777 . . . . 73.22 112.884 -177.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.31 -40.4 77.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.511 0.195 . . . . 71.24 111.056 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.1 tp -67.35 -38.94 85.62 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.225 0.61 . . . . 73.42 110.824 174.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 92.1 mt -65.71 -31.81 73.02 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.14 -0.937 . . . . 75.25 112.003 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -69.53 -32.26 70.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.369 0.668 . . . . 72.2 111.762 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 74.9 mt -68.77 -46.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 120.955 0.407 . . . . 74.22 110.283 178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -105.29 26.97 8.73 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.864 0.691 . . . . 74.41 112.864 -173.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.668 ' HA ' HD22 ' A' ' 23' ' ' LEU . 66.2 t30 -71.09 103.92 2.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.323 0.583 . . . . 72.33 111.263 -175.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -90.68 -22.7 21.02 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.646 -1.161 . . . . 74.0 109.892 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.03 -38.23 1.63 Allowed Glycine 0 C--N 1.336 0.555 0 C-N-CA 120.847 -0.692 . . . . 54.24 113.269 177.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.442 ' HA3' ' OE2' ' A' ' 54' ' ' GLU . . . -137.38 179.66 17.86 Favored Glycine 0 CA--C 1.504 -0.621 0 C-N-CA 121.174 -0.536 . . . . 62.15 111.967 -177.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.678 ' HD3' HG21 ' A' ' 49' ' ' ILE . 0.6 OUTLIER -77.59 -29.2 51.9 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 116.9 0.35 . . . . 75.33 110.904 -172.538 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -66.51 -47.84 71.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.835 0.71 . . . . 74.4 110.371 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.51 -32.88 82.97 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.637 -0.711 . . . . 64.35 113.265 176.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 16' ' ' ASN . 1.1 mm? -67.72 -40.65 84.23 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.35 0.5 . . . . 62.33 112.35 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 96.0 mtp -69.36 -28.91 66.61 Favored 'General case' 0 C--O 1.219 -0.544 0 O-C-N 123.053 0.22 . . . . 73.11 111.582 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -73.43 -43.46 60.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.191 0.196 . . . . 72.12 111.359 173.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.17 -42.53 99.42 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 74.24 111.867 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.747 HG21 ' HB2' ' A' ' 42' ' ' ALA . 83.1 mt -71.82 -42.85 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.053 -0.521 . . . . 75.41 111.518 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -62.62 -41.6 99.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.184 0.594 . . . . 74.5 111.96 -176.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.98 -34.6 50.83 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.91 -0.586 . . . . 74.21 112.049 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.519 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -97.18 18.03 15.88 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 113.242 0.83 . . . . 74.41 113.242 -171.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -54.02 -53.22 60.79 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 113.51 0.93 . . . . 75.31 113.51 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -76.24 -7.83 18.26 Favored 'Trans proline' 0 C--N 1.382 2.329 0 CA-C-N 121.18 1.457 . . . . 75.4 113.954 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.486 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 92.5 m-85 -90.01 -30.91 17.45 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 122.518 0.327 . . . . 75.21 111.769 -175.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 63.5 mtt -67.53 -75.78 0.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 122.969 0.508 . . . . 74.2 111.817 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.7 t70 179.64 169.74 1.11 Allowed 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 104.96 -2.237 . . . . 54.54 104.96 -172.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.07 -40.04 47.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 119.04 0.836 . . . . 71.53 110.852 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.49 -41.7 72.33 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.225 0.536 . . . . 73.34 111.027 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 4.2 tpt -69.97 -26.84 64.29 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 114.96 -1.018 . . . . 72.51 111.22 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -69.14 -42.69 75.66 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.477 0.711 . . . . 74.44 111.552 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -65.0 -34.56 78.72 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.562 0.539 . . . . 72.34 111.116 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.6 tp -66.11 -48.99 69.08 Favored 'General case' 0 C--O 1.216 -0.694 0 O-C-N 123.888 0.743 . . . . 73.31 110.444 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.747 ' HB2' HG21 ' A' ' 27' ' ' ILE . . . -58.85 -41.01 85.97 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.628 1.171 . . . . 71.4 114.06 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -67.03 -34.89 78.69 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.337 0.398 . . . . 73.31 111.69 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -76.27 -34.23 59.14 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 74.01 111.443 178.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.428 HG23 HD13 ' A' ' 49' ' ' ILE . 7.5 m -65.85 -37.09 85.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.072 0.549 . . . . 61.14 110.741 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.74 -34.05 75.14 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.343 0.868 . . . . 74.01 113.343 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.18 -22.02 62.08 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.903 0.382 . . . . 74.22 111.62 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -88.5 -29.73 19.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.083 -0.508 . . . . 75.24 111.509 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.678 HG21 ' HD3' ' A' ' 20' ' ' LYS . 25.6 mt -91.95 -24.81 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 111.357 0.132 . . . . 75.2 111.357 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.02 -46.49 97.6 Favored Pre-proline 0 CA--C 1.557 1.213 0 N-CA-C 114.699 1.37 . . . . 73.53 114.699 177.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -80.31 3.89 7.28 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 121.64 1.56 . . . . 74.43 114.748 176.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.528 HD23 ' HG2' ' A' ' 56' ' ' GLU . 78.9 mt -88.79 169.14 11.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.444 -0.576 . . . . 74.12 109.444 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.5 p -103.58 174.27 5.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.376 -0.374 . . . . 73.51 110.314 173.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.442 ' OE2' ' HA3' ' A' ' 19' ' ' GLY . 54.4 tp10 -66.1 -36.51 83.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.886 -0.597 . . . . 74.43 110.565 175.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.483 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 52.0 m-80 -74.12 -32.68 63.29 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.828 -0.624 . . . . 75.22 111.859 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.528 ' HG2' HD23 ' A' ' 52' ' ' LEU . 8.0 tp10 -65.75 -37.03 85.25 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.805 0.442 . . . . 75.22 111.769 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.722 ' HH ' HD12 ' A' ' 62' ' ' ILE . 45.6 t80 -69.83 -32.95 71.65 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.4 -0.363 . . . . 74.03 110.654 176.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.25 -22.86 57.54 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.123 0.416 . . . . 63.21 112.123 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 13.9 mm-40 -68.0 -39.03 83.31 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.825 -0.435 . . . . 74.01 109.825 171.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.432 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 74.9 mt -71.58 -57.06 4.74 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 115.537 -0.756 . . . . 75.31 110.631 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 59.41 20.46 8.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.238 1.415 . . . . 73.15 112.788 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.722 HD12 ' HH ' ' A' ' 57' ' ' TYR . 5.2 mp 56.63 88.37 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 124.767 1.227 . . . . 74.44 110.066 -167.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.432 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 55.5 m-85 -68.44 -42.04 79.44 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.44 -0.8 . . . . 74.1 111.344 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.4 ' HB2' HD13 ' A' ' 6' ' ' ILE . . . -122.21 106.8 11.46 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.774 -0.648 . . . . 51.44 111.926 -171.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.771 0 CA-C-N 115.679 -0.692 . . . . 63.23 109.946 169.689 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 76.1 mt . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 109.613 -0.514 . . . . 75.45 109.613 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 t -99.31 -174.49 2.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.916 -0.772 . . . . 75.43 108.916 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.453 ' HA ' ' O ' ' A' ' 64' ' ' ALA . 4.1 mp -63.85 -30.9 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.645 0.778 . . . . 73.24 112.324 -171.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -65.5 -47.17 76.91 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.642 0.377 . . . . 73.03 111.462 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 2.2 mp0 -68.38 -37.1 80.08 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.403 0.439 . . . . 65.42 111.542 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.4 m -73.73 -29.5 62.28 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 123.292 0.37 . . . . 73.14 111.478 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -69.55 -35.32 75.33 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.858 0.463 . . . . 73.53 110.461 173.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.522 HD22 ' HA ' ' A' ' 42' ' ' ALA . 14.3 tp -67.23 -40.24 86.34 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.813 174.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.619 ' HA ' HD13 ' A' ' 23' ' ' LEU . 88.5 mt -61.34 -38.95 88.78 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.763 0.665 . . . . 74.3 110.824 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 t -64.21 -34.01 77.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.114 0.966 . . . . 71.14 112.259 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 88.4 mt -74.29 -43.63 49.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 O-C-N 123.299 0.375 . . . . 75.15 111.228 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.481 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 78.9 m-85 -109.61 21.79 16.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.273 0.842 . . . . 75.01 113.273 -167.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.3 t30 -87.1 114.66 23.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.268 0.556 . . . . 74.52 111.361 -177.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.458 ' HB2' ' HA3' ' A' ' 22' ' ' GLY . 28.0 mm-40 -97.82 6.12 48.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.369 -0.832 . . . . 74.11 111.624 176.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.51 51.8 1.18 Allowed Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.914 -0.874 . . . . 61.13 110.914 -175.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.55 167.47 11.72 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.826 -0.509 . . . . 64.2 111.826 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.39 -18.12 57.59 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 111.918 0.34 . . . . 72.23 111.918 -176.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.465 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 48.0 ttm-85 -64.72 -44.1 91.29 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.514 -0.766 . . . . 64.32 109.776 176.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.458 ' HA3' ' HB2' ' A' ' 17' ' ' GLU . . . -61.22 -31.61 77.6 Favored Glycine 0 C--N 1.341 0.838 0 O-C-N 124.014 0.821 . . . . 62.41 113.612 174.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.619 HD13 ' HA ' ' A' ' 12' ' ' LEU . 3.9 mm? -65.81 -43.63 88.09 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 122.548 0.339 . . . . 73.31 111.703 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 54.4 mtt -73.64 -35.4 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.156 0.428 . . . . 75.21 112.156 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 47.1 mm-40 -65.54 -50.35 65.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.647 0.261 . . . . 74.32 111.41 175.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.481 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.4 m-80 -69.71 -42.48 73.98 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.167 0.802 . . . . 63.35 113.167 -174.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 54.9 mt -68.73 -48.53 70.78 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.591 0 CA-C-O 118.84 -0.6 . . . . 74.33 111.763 -178.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -66.63 -30.19 70.41 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.361 0.875 . . . . 72.31 113.361 -175.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.29 -37.86 25.21 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.679 0.251 . . . . 62.35 111.679 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.697 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.43 19.09 15.06 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.579 0.585 . . . . 73.14 112.579 -174.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 51.6 mt -56.32 -51.99 76.61 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-O 118.12 -0.943 . . . . 71.0 112.48 173.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.5 -15.53 45.33 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.025 1.817 . . . . 71.52 114.027 174.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.697 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.7 m-85 -90.88 -5.01 56.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.941 0.496 . . . . 72.1 111.267 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 60.3 mtt -84.2 171.73 12.53 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.019 -0.363 . . . . 73.15 110.019 173.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -77.34 0.14 Allowed 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.384 -0.371 . . . . 74.3 111.216 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -175.94 -47.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.11 0.964 . . . . 70.11 108.779 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.6 -42.41 82.49 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.11 -0.95 . . . . 64.34 109.912 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 2.0 tpt -71.65 -27.04 62.81 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.574 -0.739 . . . . 72.3 111.572 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 39' ' ' ARG . 42.2 ttm180 -74.98 -46.58 34.37 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.022 0.529 . . . . 75.22 111.591 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -62.89 -34.41 77.36 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.069 0.461 . . . . 73.02 111.471 175.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 tp -66.72 -41.63 87.62 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.224 -0.898 . . . . 74.54 110.902 175.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.522 ' HA ' HD22 ' A' ' 11' ' ' LEU . . . -63.64 -38.11 89.88 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.456 0.909 . . . . 75.54 113.456 -175.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -64.12 -42.91 96.66 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 123.636 0.585 . . . . 74.42 111.178 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -73.02 -34.6 66.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.709 -0.678 . . . . 74.3 112.334 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 49' ' ' ILE . 35.0 m -71.34 -41.39 69.88 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.599 -0.273 . . . . 73.11 110.971 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.2 mt -65.36 -29.38 70.1 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.656 0.613 . . . . 63.51 112.656 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.08 -19.74 62.43 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.156 0.428 . . . . 72.24 112.156 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -29.21 22.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.316 0.246 . . . . 72.43 111.609 176.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 45' ' ' THR . 4.2 mt -90.17 -14.79 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-O 120.851 0.358 . . . . 65.01 110.683 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -47.02 99.41 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 114.013 1.116 . . . . 72.33 114.013 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -75.58 7.05 3.26 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 121.675 1.583 . . . . 74.32 114.484 172.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.3 mt -106.19 174.26 5.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.886 0.374 . . . . 74.51 110.517 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.6 p -112.01 -168.11 1.27 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.69 -0.856 . . . . 75.31 108.69 167.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.36 -7.8 57.35 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.534 -0.173 . . . . 70.21 110.534 175.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -72.93 -47.73 43.14 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.703 -0.48 . . . . 73.0 109.703 170.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -71.27 -29.43 65.06 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.534 . . . . 74.4 111.701 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -69.42 -36.92 77.16 Favored 'General case' 0 C--O 1.217 -0.629 0 O-C-N 123.278 0.361 . . . . 75.33 110.597 174.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.16 -17.48 60.91 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.031 0.382 . . . . 72.41 112.031 -177.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -66.76 -37.29 84.33 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.117 -0.492 . . . . 74.23 110.826 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.545 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 43.2 mt -83.26 -59.65 2.4 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.72 -0.673 . . . . 72.24 110.799 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.87 -107.22 0.35 Allowed 'General case' 0 C--N 1.344 0.361 0 O-C-N 125.251 1.594 . . . . 75.45 110.67 -171.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 31.2 mm -126.1 98.64 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.674 -0.862 . . . . 73.05 108.674 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.545 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 4.7 m-85 -91.87 -85.94 0.24 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.172 -0.467 . . . . 71.11 111.927 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' ' HA ' ' A' ' 6' ' ' ILE . . . -96.5 82.83 3.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.264 0.554 . . . . 75.2 110.99 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.591 0 CA-C-N 115.577 -0.738 . . . . 65.42 110.124 173.591 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 N--CA 1.443 -0.818 0 N-CA-C 108.624 -0.88 . . . . 74.02 108.624 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -74.01 156.94 37.0 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.584 -0.735 . . . . 73.21 109.519 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mm -64.24 -32.85 59.13 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 122.64 0.376 . . . . 72.05 111.142 -177.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -69.7 -34.66 74.21 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.14 -0.482 . . . . 74.24 111.211 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.476 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 39.0 mt-10 -69.71 -41.82 74.86 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.584 0.553 . . . . 73.33 111.199 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.487 ' HA ' HD12 ' A' ' 12' ' ' LEU . 2.3 m -75.35 -24.89 57.38 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.482 0.489 . . . . 65.41 111.506 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.46 -36.74 81.75 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.259 -0.276 . . . . 75.44 110.863 169.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.512 HD12 ' HG2' ' A' ' 38' ' ' MET . 46.2 tp -64.66 -36.52 84.53 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.069 0.548 . . . . 64.3 110.074 173.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.761 ' HA ' HD11 ' A' ' 23' ' ' LEU . 81.7 mt -67.11 -39.64 86.71 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.259 -0.882 . . . . 74.41 111.091 173.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.416 ' HA ' HD11 ' A' ' 62' ' ' ILE . 22.8 t -69.41 -26.16 64.49 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.964 0.906 . . . . 75.52 112.919 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 73.8 mt -79.38 -35.23 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 122.277 0.231 . . . . 62.43 110.622 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -114.96 24.64 11.55 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.913 0.709 . . . . 74.23 112.913 -173.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -85.26 90.48 7.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.384 0.611 . . . . 54.23 110.112 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -114.67 -25.22 8.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.922 -1.035 . . . . 73.1 111.275 -176.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -169.87 64.86 0.17 Allowed Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.004 -1.093 . . . . 41.34 113.489 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.16 -155.49 47.67 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 111.608 -0.597 . . . . 65.53 111.608 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.487 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 2.6 pptp? -83.51 -11.71 57.12 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.211 0.505 . . . . 75.11 110.324 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 ttp85 -68.35 -53.27 25.21 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.194 -0.669 . . . . 74.31 109.194 170.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.9 -32.93 76.44 Favored Glycine 0 C--N 1.342 0.898 0 O-C-N 124.392 1.058 . . . . 73.31 113.442 173.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.761 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.6 mm? -68.14 -49.71 59.29 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 117.11 0.455 . . . . 70.42 112.196 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.478 ' HG2' HD22 ' A' ' 46' ' ' LEU . 50.7 mtt -66.72 -34.16 77.23 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.518 0.562 . . . . 72.14 112.518 -176.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -70.07 -51.22 33.7 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.33 0.252 . . . . 75.41 111.556 175.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -76.66 -29.25 56.3 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.997 0.74 . . . . 72.41 112.997 -170.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.47 HD12 HD13 ' A' ' 23' ' ' LEU . 60.6 mt -69.04 -50.45 53.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 117.88 0.309 . . . . 75.42 110.447 175.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -67.61 -33.33 74.78 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.113 0.783 . . . . 61.42 113.113 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.99 -33.48 61.86 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.776 0.322 . . . . 74.35 111.637 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.704 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.15 19.52 19.41 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.542 0.571 . . . . 73.32 112.542 -176.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.1 mt -56.4 -50.12 89.47 Favored Pre-proline 0 CA--C 1.55 0.947 0 CA-C-O 118.266 -0.873 . . . . 74.12 112.502 171.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.99 -23.6 53.87 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 121.656 1.57 . . . . 74.44 113.923 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.704 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.0 m-85 -77.78 -36.46 50.43 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.803 0.441 . . . . 65.33 111.628 -177.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.3 ptp -82.21 168.81 17.28 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.714 0.292 . . . . 74.44 110.787 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -72.28 154.27 41.07 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.872 -0.603 . . . . 73.11 109.521 176.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -70.44 -20.19 62.92 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.673 0.619 . . . . 73.44 112.673 -175.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -65.77 -44.8 84.73 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.006 0.431 . . . . 72.33 110.415 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' MET . . . . . 0.512 ' HG2' HD12 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -76.27 -25.16 54.67 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.034 -0.985 . . . . 75.52 111.009 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -71.86 -44.71 63.34 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.3 1.04 . . . . 72.13 111.471 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -71.26 -29.95 65.71 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.742 0.417 . . . . 74.1 111.462 174.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -61.57 -34.05 74.92 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.201 -0.909 . . . . 75.35 111.381 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.48 75.89 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.548 0.944 . . . . 72.14 113.548 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.07 -38.8 92.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 74.5 110.434 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 44' ' ' ARG . 39.3 mtt180 -71.32 -53.53 13.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.959 -1.019 . . . . 54.14 112.213 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.8 m -61.41 -44.97 96.21 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.651 0.78 . . . . 70.15 112.733 -172.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.478 HD22 ' HG2' ' A' ' 24' ' ' MET . 96.3 mt -64.94 -27.43 68.84 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.783 0.661 . . . . 72.21 112.783 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.4 64.43 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.857 0.688 . . . . 73.43 112.857 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.32 -27.6 29.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.693 0.224 . . . . 72.31 110.997 177.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.44 ' HA ' HD13 ' A' ' 52' ' ' LEU . 3.0 mt -97.17 -12.09 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-O 121.041 0.448 . . . . 74.22 110.904 -173.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.12 97.57 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 114.341 1.237 . . . . 73.13 114.341 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -79.51 11.23 2.75 Favored 'Trans proline' 0 C--N 1.383 2.361 0 CA-C-N 122.152 1.804 . . . . 73.43 114.307 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 49' ' ' ILE . 95.8 mt -108.29 -179.66 3.95 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 122.762 0.425 . . . . 74.22 110.118 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.448 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 6.4 t -139.11 -169.95 2.77 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.471 -0.937 . . . . 74.34 108.471 174.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -64.79 -43.39 93.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.53 0.732 . . . . 73.23 112.7 -167.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.448 ' OD1' HG21 ' A' ' 53' ' ' THR . 30.7 p-10 -67.78 -32.45 73.03 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.678 0.612 . . . . 72.43 112.285 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -67.17 -41.64 85.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 123.733 0.646 . . . . 72.13 111.844 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.582 ' HE1' HD11 ' A' ' 12' ' ' LEU . 88.5 t80 -75.29 -38.46 60.36 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.477 0.486 . . . . 75.42 111.467 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.81 -24.04 66.83 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.807 1.04 . . . . 71.45 113.807 -168.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.08 -34.08 43.92 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.584 0.216 . . . . 73.3 111.584 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 mt -75.85 -56.38 4.73 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.238 -0.653 . . . . 74.55 109.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.58 -108.52 0.42 Allowed 'General case' 0 C--N 1.346 0.425 0 O-C-N 125.498 1.749 . . . . 74.32 113.17 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.416 HD11 ' HA ' ' A' ' 13' ' ' SER . 17.1 mm -113.2 88.31 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.072 -1.085 . . . . 72.33 108.072 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -103.64 -10.64 18.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.48 -0.782 . . . . 71.41 112.01 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.445 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -146.44 82.04 1.58 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 55.54 111.339 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.622 0 CA-C-N 115.552 -0.749 . . . . 72.43 109.192 170.128 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.547 HD23 ' HG3' ' A' ' 48' ' ' LYS . 85.7 mt . . . . . 0 CA--C 1.51 -0.561 0 CA-C-O 121.13 0.491 . . . . 72.3 111.527 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.451 HG21 ' HG2' ' A' ' 8' ' ' GLU . 14.9 t -90.3 166.78 13.13 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.389 -0.823 . . . . 71.53 109.004 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.3 mm -69.41 -27.35 33.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 116.228 -0.442 . . . . 71.41 110.715 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.54 -45.59 78.9 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.592 0.757 . . . . 71.21 112.378 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.451 ' HG2' HG21 ' A' ' 5' ' ' THR . 43.0 mm-40 -64.29 -43.91 93.27 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.556 0.535 . . . . 65.52 110.362 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.684 ' HA ' HD12 ' A' ' 12' ' ' LEU . 3.1 m -73.46 -26.54 60.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.777 -1.101 . . . . 61.21 111.325 -176.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.437 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.8 t-20 -69.44 -36.51 76.71 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.005 0.522 . . . . 73.14 111.45 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.623 HD12 HD13 ' A' ' 14' ' ' ILE . 38.0 tp -74.01 -33.17 63.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.879 0.371 . . . . 74.12 110.538 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.684 HD12 ' HA ' ' A' ' 9' ' ' THR . 69.4 mt -63.53 -35.32 80.07 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-N 115.634 -0.712 . . . . 74.53 110.622 170.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -70.68 -24.55 62.7 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.526 0.73 . . . . 74.23 111.988 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.623 HD13 HD12 ' A' ' 11' ' ' LEU . 96.6 mt -69.93 -34.38 59.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 123.006 0.522 . . . . 73.23 110.266 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -107.39 -84.95 0.52 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.26 -0.4 . . . . 70.53 111.309 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.598 ' HA ' HD22 ' A' ' 23' ' ' LEU . 64.3 t30 57.13 83.83 0.1 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.389 1.476 . . . . 62.0 111.829 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.412 ' H ' HD21 ' A' ' 23' ' ' LEU . 38.5 tt0 -149.53 123.63 9.46 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.763 -1.108 . . . . 72.41 110.03 -177.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.17 24.02 74.53 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 115.535 0.974 . . . . 71.42 115.535 167.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.92 -150.19 42.35 Favored Glycine 0 C--O 1.221 -0.695 0 C-N-CA 121.153 -0.546 . . . . 74.13 112.497 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 57' ' ' TYR . 14.2 tmtt? -64.97 -43.35 92.94 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.95 0.5 . . . . 74.35 111.085 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -72.81 -45.4 58.68 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.051 -0.977 . . . . 74.33 111.318 -172.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.38 -30.08 74.89 Favored Glycine 0 CA--C 1.524 0.627 0 O-C-N 123.757 0.661 . . . . 75.02 113.137 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.598 HD22 ' HA ' ' A' ' 16' ' ' ASN . 0.5 OUTLIER -64.24 -37.89 89.09 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.821 0.31 . . . . 74.23 110.905 173.664 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.626 ' HG2' HD21 ' A' ' 46' ' ' LEU . 37.8 mtt -69.42 -39.41 77.88 Favored 'General case' 0 C--O 1.221 -0.415 0 O-C-N 123.234 0.334 . . . . 74.32 111.505 175.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -63.71 -40.81 97.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.693 0.397 . . . . 72.03 111.723 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -77.98 -42.68 32.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.712 -0.676 . . . . 75.42 111.174 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.0 mt -72.63 -38.48 58.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 119.107 -0.473 . . . . 74.22 111.868 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -63.36 -35.76 81.47 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.254 0.479 . . . . 63.52 111.693 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -19.26 61.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.109 -0.496 . . . . 71.35 112.307 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.617 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -113.79 17.29 18.17 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.415 0.524 . . . . 62.53 112.415 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.51 -44.65 56.55 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 113.441 0.904 . . . . 75.22 113.441 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.26 7.95 2.74 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 121.709 1.606 . . . . 55.14 114.122 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.617 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 95.9 m-85 -114.29 -168.8 1.41 Allowed 'General case' 0 C--O 1.242 0.681 0 C-N-CA 123.12 0.568 . . . . 74.32 109.618 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 68.0 mtm 68.16 -88.81 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.309 1.444 . . . . 75.14 111.454 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -167.85 164.1 14.05 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 106.832 -1.544 . . . . 75.02 106.832 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.64 -31.71 71.91 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.043 0.383 . . . . 61.51 111.734 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.34 -39.01 55.06 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.0 0.52 . . . . 73.24 110.508 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 5.7 mtt -68.03 -28.51 67.46 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 115.914 -0.585 . . . . 64.43 111.882 174.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -71.04 -43.02 68.72 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 123.311 0.645 . . . . 75.31 111.156 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -67.98 -32.17 72.38 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 111.562 0.208 . . . . 74.33 111.562 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.72 -48.07 78.56 Favored 'General case' 0 C--O 1.213 -0.846 0 O-C-N 123.644 0.59 . . . . 74.51 109.653 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.63 -34.76 76.24 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.348 1.059 . . . . 71.32 113.537 -177.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -66.27 -35.97 81.79 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 123.688 0.617 . . . . 75.42 111.813 177.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -79.75 -28.98 40.38 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.468 0.48 . . . . 74.03 111.515 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.401 HG23 ' HZ2' ' A' ' 48' ' ' LYS . 6.6 m -75.35 -30.66 60.31 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.945 0.402 . . . . 75.43 110.39 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.626 HD21 ' HG2' ' A' ' 24' ' ' MET . 67.6 mt -76.71 -31.16 57.02 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.182 0.438 . . . . 72.23 112.182 169.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.42 -33.12 73.65 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.743 0.645 . . . . 74.45 112.743 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.547 ' HG3' HD23 ' A' ' 4' ' ' LEU . 0.1 OUTLIER -86.4 -17.21 34.95 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.914 0.339 . . . . 73.33 111.914 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.515 HG22 HD11 ' A' ' 52' ' ' LEU . 31.7 pt -97.82 -8.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 120.415 -0.514 . . . . 75.22 112.005 174.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.66 -46.32 99.59 Favored Pre-proline 0 CA--C 1.557 1.216 0 CA-C-O 118.261 -0.876 . . . . 61.34 113.208 171.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.45 -5.91 15.92 Favored 'Trans proline' 0 C--N 1.381 2.266 0 CA-C-N 121.62 1.614 . . . . 71.22 114.139 171.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.515 HD11 HG22 ' A' ' 49' ' ' ILE . 76.7 mt -92.17 153.07 19.55 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.886 0.374 . . . . 70.53 110.115 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 p -95.01 -176.89 3.97 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.982 175.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.56 -30.28 69.87 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.902 -0.59 . . . . 75.55 111.362 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -71.72 -39.4 70.16 Favored 'General case' 0 C--O 1.226 -0.183 0 O-C-N 123.724 0.64 . . . . 73.23 110.527 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.3 -42.04 93.48 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 123.716 0.635 . . . . 64.53 112.711 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.457 ' HB3' ' HB2' ' A' ' 20' ' ' LYS . 80.1 t80 -75.58 -26.15 57.65 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.052 0.22 . . . . 73.12 111.218 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.96 -29.04 66.06 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.94 0.336 . . . . 73.34 111.341 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.38 -23.44 61.11 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 123.456 0.472 . . . . 75.32 111.811 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -93.75 -69.06 0.77 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.639 0.376 . . . . 74.13 111.808 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.94 -135.02 1.46 Allowed 'General case' 0 C--N 1.352 0.709 0 C-N-CA 124.741 1.216 . . . . 72.24 110.709 -172.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.4 mm -97.1 98.0 6.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.002 -1.111 . . . . 74.52 108.002 172.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -117.45 -9.6 10.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.334 -0.848 . . . . 71.22 111.794 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.94 -29.04 3.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.462 0.542 . . . . 74.42 112.462 -173.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.515 0 N-CA-C 112.901 0.704 . . . . 73.13 112.901 -174.469 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.8 mt . . . . . 0 CA--C 1.516 -0.363 0 CA-C-O 120.604 0.24 . . . . 72.14 110.401 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.8 p -87.33 169.8 11.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.163 -0.471 . . . . 70.22 110.836 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 50.5 mt -70.8 -22.49 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.743 -0.662 . . . . 71.45 109.803 177.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.42 -55.04 27.54 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.136 0.575 . . . . 74.33 111.22 174.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.01 -37.33 69.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.675 -0.693 . . . . 72.32 111.912 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.729 ' HA ' HD12 ' A' ' 12' ' ' LEU . 7.6 m -74.75 -27.82 60.51 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.402 -0.363 . . . . 74.31 111.89 -179.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -65.25 -38.22 89.66 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 122.198 -0.314 . . . . 74.04 110.524 174.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.526 ' HA ' HD11 ' A' ' 14' ' ' ILE . 21.3 tp -70.65 -32.55 69.88 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.619 0.574 . . . . 73.23 111.023 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.729 HD12 ' HA ' ' A' ' 9' ' ' THR . 86.9 mt -61.91 -40.92 97.12 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.868 -0.605 . . . . 63.54 111.178 171.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 t -71.5 -27.55 63.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.312 0.645 . . . . 64.4 112.093 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.526 HD11 ' HA ' ' A' ' 11' ' ' LEU . 75.6 mt -63.79 -37.5 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.395 0.678 . . . . 73.12 111.116 176.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -94.88 -87.75 0.26 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 119.584 -0.246 . . . . 74.54 110.449 175.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.419 ' HA ' HD22 ' A' ' 23' ' ' LEU . 58.2 t30 50.28 66.46 1.14 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.809 1.244 . . . . 73.32 111.798 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -85.49 -75.87 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.564 -0.744 . . . . 75.14 110.806 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -141.8 66.62 0.48 Allowed Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 111.437 -0.665 . . . . 34.31 111.437 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.68 -160.11 37.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.411 -0.424 . . . . 74.22 112.117 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.607 ' HE2' HG21 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -70.4 -29.4 66.01 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.567 0.58 . . . . 72.12 112.567 -174.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.9 mtt180 -71.5 -44.78 64.06 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 123.165 0.291 . . . . 71.44 110.434 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.69 -27.34 68.11 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 123.552 0.533 . . . . 74.23 112.828 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 23' ' ' LEU . 1.2 mm? -71.41 -56.44 5.95 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-O 119.403 -0.332 . . . . 73.45 111.884 172.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 97.6 mtp -72.2 -35.99 69.09 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.574 0.583 . . . . 61.41 112.574 -169.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.3 -45.67 86.96 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.121 0.568 . . . . 65.43 112.202 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -78.36 -24.44 46.45 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.166 0.432 . . . . 65.43 112.166 -177.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.766 HG22 ' HB3' ' A' ' 42' ' ' ALA . 20.8 mt -67.01 -46.52 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 119.59 -0.243 . . . . 73.31 110.648 173.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -66.2 -33.73 76.43 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.501 0.556 . . . . 74.11 112.501 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.01 -36.17 59.25 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 123.458 0.473 . . . . 62.31 112.145 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.703 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.28 21.07 18.06 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.966 0.728 . . . . 74.01 112.966 -172.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.476 ' HB2' ' HD3' ' A' ' 32' ' ' PRO . 79.1 mt -52.27 -53.21 55.17 Favored Pre-proline 0 CA--C 1.56 1.347 0 N-CA-C 113.402 0.889 . . . . 74.34 113.402 173.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 31' ' ' LEU . 7.3 Cg_exo -76.33 -13.14 18.84 Favored 'Trans proline' 0 C--N 1.381 2.255 0 C-N-CA 121.982 1.788 . . . . 75.53 113.681 177.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.703 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.8 m-85 -81.49 -21.98 38.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.86 0.362 . . . . 74.23 110.742 177.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.0 mtm -84.52 163.82 19.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.863 -0.608 . . . . 71.22 110.63 171.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -85.37 177.78 7.68 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.83 -0.623 . . . . 73.11 110.518 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -42.71 -52.1 5.05 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 126.232 1.813 . . . . 75.44 114.078 -176.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -68.55 -50.59 50.71 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.301 0.64 . . . . 74.15 111.441 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 62.6 mtt -70.46 -27.43 64.23 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 124.006 0.816 . . . . 51.33 112.769 -172.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -65.84 -50.88 63.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.526 0.73 . . . . 73.43 111.12 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.16 -32.4 63.11 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.801 0.667 . . . . 72.55 112.801 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -69.17 -28.73 66.67 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.164 0.585 . . . . 75.25 110.777 178.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.766 ' HB3' HG22 ' A' ' 27' ' ' ILE . . . -66.12 -36.23 82.61 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 112.655 0.613 . . . . 64.53 112.655 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.86 -33.07 74.04 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 123.398 0.436 . . . . 74.14 111.591 176.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.414 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 79.4 mtp180 -68.32 -39.12 82.1 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.646 -0.706 . . . . 75.32 110.81 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.458 ' O ' HG13 ' A' ' 49' ' ' ILE . 6.9 m -73.65 -35.06 65.22 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.745 -0.661 . . . . 71.41 111.064 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 79.3 mt -62.47 -38.14 88.67 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.566 0.346 . . . . 73.2 111.534 173.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.61 -15.32 62.74 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.338 -0.847 . . . . 44.32 112.43 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 46.5 mmtm -88.36 -42.03 12.46 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.505 0.558 . . . . 72.43 112.505 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.607 HG21 ' HE2' ' A' ' 20' ' ' LYS . 6.5 mt -83.26 -25.26 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 117.838 0.29 . . . . 74.2 111.736 -172.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.1 -45.84 73.01 Favored Pre-proline 0 CA--C 1.552 1.019 0 N-CA-C 113.801 1.037 . . . . 75.31 113.801 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -76.0 -6.26 17.19 Favored 'Trans proline' 0 C--N 1.376 2.011 0 CA-C-N 122.194 1.819 . . . . 71.43 114.212 174.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.3 mt -90.96 162.38 14.77 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.033 0.444 . . . . 74.23 109.986 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.431 HG22 ' HG3' ' A' ' 56' ' ' GLU . 14.5 t -93.33 174.64 7.11 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 109.495 -0.558 . . . . 60.51 109.495 170.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.51 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 12.8 pt-20 -68.2 -26.89 65.96 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.202 0.601 . . . . 74.11 112.173 -179.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -74.34 -40.53 62.11 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 122.242 0.217 . . . . 75.45 110.863 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.431 ' HG3' HG22 ' A' ' 53' ' ' THR . 48.8 mt-10 -66.67 -37.23 84.35 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.46 0.475 . . . . 75.41 112.254 -177.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -70.11 -36.26 74.71 Favored 'General case' 0 C--O 1.217 -0.653 0 O-C-N 123.299 0.374 . . . . 73.24 110.742 175.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.99 -24.99 60.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.27 0.471 . . . . 74.44 112.27 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.15 -29.99 64.58 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.364 0.265 . . . . 74.42 111.17 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.2 mt -84.86 -43.57 14.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.126 -0.488 . . . . 70.12 110.231 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.85 -110.37 0.56 Allowed 'General case' 0 C--N 1.347 0.491 0 O-C-N 125.341 1.651 . . . . 73.54 110.994 -173.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 46.6 mm -110.93 94.95 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 106.926 -1.509 . . . . 71.31 106.926 168.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -80.32 -62.59 1.63 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.33 -1.305 . . . . 74.34 111.547 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.571 ' H ' HG21 ' A' ' 9' ' ' THR . . . -126.2 86.27 2.5 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.149 0.5 . . . . 75.31 111.438 -178.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 73.04 111.109 176.893 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.415 HD11 ' HZ3' ' A' ' 48' ' ' LYS . 3.9 mp . . . . . 0 C--O 1.233 0.219 0 CA-C-O 120.643 0.259 . . . . 72.35 110.65 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.01 171.38 8.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 116.068 -0.515 . . . . 74.23 110.37 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.48 ' HA ' ' HB2' ' A' ' 64' ' ' ALA . 17.0 mm -57.84 -47.15 86.86 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.627 0 C-N-CA 123.78 0.832 . . . . 72.55 111.517 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -60.21 -36.04 76.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.567 0.747 . . . . 70.01 112.64 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.549 ' HG2' HD12 ' A' ' 41' ' ' LEU . 32.7 mt-10 -75.17 -41.09 58.85 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.933 0.493 . . . . 72.15 111.495 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.8 m -76.64 -28.0 55.87 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 116.18 -0.464 . . . . 62.21 111.639 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -71.63 -26.21 62.47 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.097 0.559 . . . . 72.34 111.267 173.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 42' ' ' ALA . 50.6 tp -66.21 -31.01 71.58 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 122.628 0.371 . . . . 74.05 111.204 173.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.501 HD23 HD21 ' A' ' 23' ' ' LEU . 83.7 mt -60.36 -32.5 71.34 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.248 -0.433 . . . . 62.31 111.355 173.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -69.47 -25.58 64.15 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.286 0.635 . . . . 72.2 112.329 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.9 mm -69.18 -44.96 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 122.899 0.48 . . . . 73.13 111.125 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.402 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 82.9 m-85 -120.23 19.29 12.2 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.982 0.734 . . . . 74.23 112.982 -172.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.451 HD21 HD12 ' A' ' 62' ' ' ILE . 31.4 t-20 -67.88 106.98 2.47 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.077 0.465 . . . . 64.23 109.999 178.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -145.07 96.38 2.84 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.894 -1.048 . . . . 75.44 108.279 -178.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.46 42.68 32.98 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 120.697 -0.763 . . . . 75.23 111.901 -173.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.52 -138.46 21.72 Favored Glycine 0 N--CA 1.447 -0.589 0 O-C-N 123.833 0.373 . . . . 63.22 112.474 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.719 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 2.2 pptp? -95.72 -7.96 35.88 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.796 0.351 . . . . 74.55 111.253 -177.535 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -63.92 -60.28 3.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.801 -0.636 . . . . 73.51 110.318 174.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -27.93 71.58 Favored Glycine 0 C--O 1.223 -0.579 0 CA-C-N 115.702 -0.681 . . . . 75.43 112.747 176.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.719 ' HB3' ' HA ' ' A' ' 20' ' ' LYS . 57.3 tp -59.98 -44.35 94.55 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.397 0.679 . . . . 73.33 111.406 175.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 46.5 mtt -64.16 -46.99 81.6 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.232 0.456 . . . . 72.35 112.232 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -63.79 -41.68 97.89 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 123.762 0.664 . . . . 75.44 111.339 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.402 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 20.5 m-80 -71.83 -38.05 70.23 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 112.508 0.559 . . . . 72.42 112.508 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.5 mt -70.04 -44.52 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 119.301 -0.38 . . . . 72.15 111.563 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -65.65 -35.58 81.21 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.283 0.475 . . . . 63.4 112.283 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.48 -29.99 64.13 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 123.207 0.317 . . . . 75.54 111.578 177.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.736 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -99.98 16.41 24.01 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.519 0.563 . . . . 73.23 112.519 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.2 mt -67.28 -44.81 48.9 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.618 -0.706 . . . . 74.01 112.065 172.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.8 12.61 0.69 Allowed 'Trans proline' 0 C--N 1.377 2.065 0 CA-C-N 121.759 1.664 . . . . 74.42 113.911 169.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.736 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.4 m-85 -124.47 -154.92 0.64 Allowed 'General case' 0 C--O 1.239 0.517 0 C-N-CA 123.72 0.808 . . . . 73.55 109.222 177.117 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 70.8 mtm 67.47 -94.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.297 1.439 . . . . 74.3 112.796 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -174.74 147.58 1.04 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.479 -1.675 . . . . 72.12 106.479 -166.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.04 -38.32 79.09 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 118.403 0.547 . . . . 72.42 112.168 -177.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.76 -45.25 75.44 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.18 0.514 . . . . 75.32 110.705 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 18.4 ttp -73.04 -24.34 60.7 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.302 -0.863 . . . . 75.2 111.844 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -69.22 -39.73 78.4 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.839 0.456 . . . . 74.11 111.626 173.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -61.72 -36.34 80.66 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.062 0.458 . . . . 75.11 111.188 173.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.549 HD12 ' HG2' ' A' ' 8' ' ' GLU . 27.2 tp -71.36 -39.06 71.49 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 115.285 -0.87 . . . . 75.31 111.04 176.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.551 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -66.41 -32.35 73.68 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.252 0.621 . . . . 72.11 112.322 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -65.39 -44.82 86.32 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.199 -0.91 . . . . 75.14 111.992 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -80.34 -22.11 41.79 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.88 0.696 . . . . 74.31 112.88 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.496 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 60.7 m -84.24 -27.29 28.03 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 120.816 0.341 . . . . 73.13 110.868 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 28.9 mt -66.99 -33.73 76.22 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 122.101 -0.375 . . . . 73.31 111.709 168.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.52 -20.53 60.63 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 123.584 0.553 . . . . 72.33 112.239 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -87.18 -25.76 23.89 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 119.484 -0.293 . . . . 75.1 111.6 178.624 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.442 HG21 HD12 ' A' ' 52' ' ' LEU . 15.4 pt -92.66 -14.76 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 112.395 0.517 . . . . 74.41 112.395 178.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.19 -48.01 97.71 Favored Pre-proline 0 CA--C 1.554 1.133 0 N-CA-C 114.639 1.348 . . . . 74.21 114.639 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.98 -1.32 11.15 Favored 'Trans proline' 0 C--N 1.38 2.215 0 CA-C-N 121.96 1.736 . . . . 74.43 113.98 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.442 HD12 HG21 ' A' ' 49' ' ' ILE . 61.4 mt -86.83 149.11 25.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.202 -0.666 . . . . 75.31 109.202 177.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 t -95.02 178.23 5.62 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 108.954 -0.758 . . . . 75.24 108.954 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -74.19 -38.79 63.53 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.746 0.308 . . . . 73.15 111.553 -172.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -72.08 -29.57 64.25 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.042 -0.526 . . . . 73.02 111.021 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -71.64 -30.94 66.31 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.208 0.603 . . . . 74.21 111.18 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -74.53 -28.22 60.87 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 110.159 -0.311 . . . . 72.52 110.159 173.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.1 -22.22 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.967 0.349 . . . . 71.05 111.7 177.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -71.23 -37.57 72.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.938 -0.574 . . . . 71.21 111.688 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.425 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 13.2 mt -85.31 -53.01 5.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.142 -0.481 . . . . 74.41 110.759 -176.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.53 -109.17 0.47 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.742 1.617 . . . . 53.23 111.136 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.451 HD12 HD21 ' A' ' 16' ' ' ASN . 47.3 mm -121.55 107.39 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 107.779 -1.193 . . . . 75.32 107.779 173.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.425 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 1.2 m-85 -97.03 -73.7 0.59 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.229 -0.441 . . . . 74.54 111.775 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.48 ' HB2' ' HA ' ' A' ' 6' ' ' ILE . . . -89.98 102.14 14.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.304 0.573 . . . . 71.12 111.111 -175.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.139 -0.937 . . . . 71.43 108.966 178.332 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.474 HD12 ' HD2' ' A' ' 48' ' ' LYS . 19.0 mt . . . . . 0 C--O 1.239 0.541 0 N-CA-C 109.166 -0.679 . . . . 55.44 109.166 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -82.64 172.6 12.76 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 109.356 -0.609 . . . . 72.23 109.356 176.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.8 mm -69.65 -22.31 25.07 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.557 -0.747 . . . . 73.22 111.01 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.31 -40.21 85.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.632 0.373 . . . . 72.4 111.689 175.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -65.91 -40.84 91.85 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.271 0.357 . . . . 74.31 111.213 175.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.421 HG21 ' H ' ' A' ' 64' ' ' ALA . 6.4 m -70.14 -34.77 73.46 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.958 -0.564 . . . . 70.51 111.467 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.482 ' O ' HG13 ' A' ' 14' ' ' ILE . 13.0 t30 -71.31 -30.82 66.69 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.659 0.784 . . . . 73.54 111.725 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.44 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 22.8 tp -62.29 -40.07 95.06 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 123.411 0.444 . . . . 74.11 111.086 176.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 66.1 mt -70.91 -32.47 69.41 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.336 -0.847 . . . . 73.42 111.065 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.0 t -70.62 -26.22 63.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.514 0.726 . . . . 75.51 112.435 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 10' ' ' ASN . 97.1 mt -61.77 -48.47 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 122.864 0.466 . . . . 65.34 111.319 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -98.0 -76.18 0.53 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.627 -0.261 . . . . 73.21 110.803 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.707 ' HA ' HD21 ' A' ' 23' ' ' LEU . 15.8 t-20 53.65 81.13 0.1 Allowed 'General case' 0 N--CA 1.474 0.739 0 O-C-N 124.925 1.391 . . . . 74.22 111.7 -177.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -102.57 -95.2 0.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.713 -0.395 . . . . 71.53 111.316 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.468 ' H ' ' HA3' ' A' ' 22' ' ' GLY . . . -118.59 82.35 0.33 Allowed Glycine 0 CA--C 1.501 -0.806 0 C-N-CA 120.561 -0.828 . . . . 62.13 111.687 -177.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.06 43.06 Favored Glycine 0 C--O 1.226 -0.379 0 N-CA-C 111.598 -0.601 . . . . 73.14 111.598 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 53' ' ' THR . 2.7 pptp? -89.15 -18.2 27.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.518 0.159 . . . . 73.25 110.939 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 mtt85 -66.39 -51.15 60.0 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 123.424 0.453 . . . . 75.43 110.35 173.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.468 ' HA3' ' H ' ' A' ' 18' ' ' GLY . . . -63.89 -29.16 74.01 Favored Glycine 0 C--N 1.339 0.731 0 O-C-N 123.966 0.791 . . . . 72.32 113.051 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.707 HD21 ' HA ' ' A' ' 16' ' ' ASN . 2.4 mm? -67.9 -51.86 43.04 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-O 118.656 -0.688 . . . . 75.54 111.275 173.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.576 ' HG2' HD22 ' A' ' 46' ' ' LEU . 52.8 mtt -63.81 -42.02 97.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.97 0.73 . . . . 74.11 112.97 -175.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -67.78 -38.09 82.93 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.305 0.483 . . . . 74.03 112.305 -177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -79.79 -33.11 40.8 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.277 0.473 . . . . 75.05 112.277 178.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.617 HG23 ' HE1' ' A' ' 34' ' ' MET . 30.5 mt -69.22 -47.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 118.908 -0.567 . . . . 75.12 111.374 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.515 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 35.1 m-80 -66.62 -31.13 71.63 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.368 0.507 . . . . 74.22 112.368 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.45 -31.26 60.25 Favored 'General case' 0 N--CA 1.464 0.248 0 O-C-N 123.177 0.298 . . . . 74.21 111.721 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.693 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.57 18.15 22.5 Favored 'General case' 0 C--O 1.223 -0.31 0 N-CA-C 112.689 0.626 . . . . 71.23 112.689 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.515 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 52.5 mt -55.88 -49.31 93.66 Favored Pre-proline 0 CA--C 1.554 1.106 0 N-CA-C 114.121 1.156 . . . . 73.41 114.121 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -79.99 0.14 10.24 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 121.912 1.742 . . . . 73.53 113.409 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.693 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.6 m-85 -97.73 -20.83 17.33 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.197 0.199 . . . . 74.53 111.397 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.617 ' HE1' HG23 ' A' ' 27' ' ' ILE . 64.3 mtt -75.08 -81.22 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.273 0.358 . . . . 74.41 111.234 -179.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.591 ' HB3' ' HB2' ' A' ' 38' ' ' MET . 34.9 t70 -179.08 161.59 1.15 Allowed 'General case' 0 C--N 1.338 0.079 0 N-CA-C 106.812 -1.551 . . . . 64.01 106.812 -170.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.54 -47.04 85.65 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.827 0.451 . . . . 75.04 111.326 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -76.88 -34.31 57.78 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.876 -0.602 . . . . 74.11 110.447 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' MET . . . . . 0.591 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 3.6 tpt -72.25 -25.48 61.64 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 123.824 0.703 . . . . 65.25 111.486 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.412 ' HG3' ' HB3' ' A' ' 31' ' ' LEU . 13.0 ttp180 -70.63 -40.55 73.05 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 122.417 0.287 . . . . 74.34 110.727 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.51 -30.12 64.22 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.246 0.546 . . . . 71.21 110.587 178.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.15 -34.96 71.47 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 115.067 -0.969 . . . . 73.34 110.639 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.44 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -65.14 -40.03 93.82 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 116.164 -0.471 . . . . 72.52 111.574 175.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -68.46 -30.06 68.84 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.623 0.577 . . . . 73.03 111.553 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 tpp180 -71.07 -46.97 60.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.09 0.556 . . . . 74.1 111.552 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 49' ' ' ILE . 11.2 m -70.62 -44.04 68.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.112 -0.494 . . . . 73.13 111.302 -176.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.576 HD22 ' HG2' ' A' ' 24' ' ' MET . 52.8 mt -70.48 -27.28 64.09 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.671 0.619 . . . . 73.23 112.671 -177.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.49 -29.15 70.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.754 0.311 . . . . 72.51 111.704 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.474 ' HD2' HD12 ' A' ' 4' ' ' LEU . 14.9 tmtt? -81.53 -33.22 31.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.196 -0.457 . . . . 74.1 110.51 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.508 ' HA ' HD13 ' A' ' 52' ' ' LEU . 11.4 mt -90.8 -11.51 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-O 120.835 0.35 . . . . 75.2 111.458 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.472 ' HA ' ' HE1' ' A' ' 24' ' ' MET . . . -58.78 -46.34 99.57 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 113.889 1.07 . . . . 74.32 113.889 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -75.66 -6.45 17.62 Favored 'Trans proline' 0 C--N 1.378 2.095 0 CA-C-N 121.76 1.664 . . . . 71.15 113.542 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.508 HD13 ' HA ' ' A' ' 49' ' ' ILE . 65.3 mt -90.11 158.22 17.39 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.603 -0.517 . . . . 74.32 109.603 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.437 HG21 ' H ' ' A' ' 55' ' ' ASN . 8.7 t -112.74 -167.37 1.18 Allowed 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.19 -0.67 . . . . 72.35 109.19 171.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.41 -29.16 69.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.122 0.569 . . . . 74.53 112.129 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 0.2 OUTLIER -65.0 -46.23 82.25 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.745 0.653 . . . . 75.3 110.348 177.143 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.453 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 2.4 mp0 -69.2 -28.79 66.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.996 0.739 . . . . 73.42 112.996 -178.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -72.45 -37.42 68.54 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 120.842 -0.343 . . . . 73.53 110.27 175.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.27 -14.04 60.48 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.436 0.532 . . . . 72.23 112.436 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 14.0 mm-40 -63.21 -31.55 72.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.084 0.469 . . . . 75.35 110.389 168.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.4 mt -89.59 -61.76 1.62 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.498 -0.774 . . . . 64.01 109.986 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.3 45.73 26.64 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 124.766 1.291 . . . . 62.42 112.495 178.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 40.9 mm 66.72 95.92 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 C-N-CA 124.796 1.238 . . . . 73.0 110.151 -174.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -85.21 -56.91 3.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.773 -1.103 . . . . 74.32 112.09 -171.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.421 ' H ' HG21 ' A' ' 9' ' ' THR . . . -114.9 -97.35 0.45 Allowed 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.934 -0.575 . . . . 73.33 111.75 -170.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.407 0 C-N-CA 126.152 1.781 . . . . 72.45 114.848 176.732 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.536 HD22 ' HZ3' ' A' ' 48' ' ' LYS . 96.6 mt . . . . . 0 CA--C 1.509 -0.604 0 CA-C-O 120.652 0.263 . . . . 73.51 110.802 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 153.13 27.16 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.778 -0.647 . . . . 63.11 109.979 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.41 -34.18 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.527 0.331 . . . . 74.32 110.865 176.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.1 -38.56 88.52 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.009 0.524 . . . . 74.41 111.4 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.516 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 36.9 mt-10 -70.42 -37.6 74.44 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 117.486 0.13 . . . . 75.54 111.31 178.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.582 ' HA ' HD13 ' A' ' 12' ' ' LEU . 5.9 m -74.81 -29.51 61.11 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 123.485 0.49 . . . . 64.32 111.369 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.466 ' O ' HG13 ' A' ' 14' ' ' ILE . 29.2 t-20 -70.92 -35.88 72.45 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.492 -0.322 . . . . 73.45 110.422 172.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.6 tp -65.95 -34.42 78.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.582 0.753 . . . . 72.2 110.882 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.767 ' HA ' HD12 ' A' ' 23' ' ' LEU . 95.6 mt -62.12 -39.99 94.38 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.514 -0.766 . . . . 73.14 110.831 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.3 t -70.41 -31.39 68.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.058 0.543 . . . . 74.13 112.27 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 10' ' ' ASN . 77.4 mt -68.77 -45.21 81.37 Favored 'Isoleucine or valine' 0 C--N 1.347 0.463 0 CA-C-O 120.908 0.385 . . . . 75.12 110.731 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -108.33 23.62 14.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.324 0.49 . . . . 75.23 112.324 -172.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 65.9 t30 -82.41 114.36 20.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.888 0.375 . . . . 72.32 110.221 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.32 -76.27 0.6 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.48 -0.782 . . . . 74.3 109.534 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.89 61.66 0.6 Allowed Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.961 -0.856 . . . . 75.43 110.961 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.6 -149.22 21.62 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.33 -0.462 . . . . 71.35 112.348 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.494 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -78.87 -15.26 58.57 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 111.789 0.292 . . . . 74.14 111.789 -176.489 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -46.35 70.73 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 109.153 -0.684 . . . . 63.52 109.153 172.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.68 -35.54 91.35 Favored Glycine 0 C--O 1.216 -0.98 0 O-C-N 124.025 0.828 . . . . 74.21 113.217 172.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.767 HD12 ' HA ' ' A' ' 12' ' ' LEU . 1.7 mm? -64.05 -46.62 83.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 117.117 0.458 . . . . 73.22 112.097 176.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 48.9 mtt -67.8 -42.43 81.62 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.952 0.352 . . . . 74.42 111.952 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -70.27 -44.05 69.23 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 112.319 0.488 . . . . 71.21 112.319 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -74.56 -31.3 62.05 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.47 0.544 . . . . 74.25 112.47 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 45.3 mt -72.6 -46.71 53.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 119.16 -0.448 . . . . 75.34 110.911 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -68.15 -25.26 65.18 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.693 0.627 . . . . 72.5 112.693 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.07 -26.39 36.33 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 111.469 0.174 . . . . 74.14 111.469 177.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.3 5.48 39.97 Favored 'General case' 0 C--O 1.209 -1.04 0 N-CA-C 112.689 0.625 . . . . 74.3 112.689 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 64.5 mt -60.6 -33.38 14.41 Favored Pre-proline 0 CA--C 1.56 1.351 0 N-CA-C 114.498 1.296 . . . . 74.14 114.498 176.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 31' ' ' LEU . 17.0 Cg_endo -60.46 -22.82 73.13 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.142 1.894 . . . . 75.32 114.283 166.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -105.12 -140.15 0.37 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.057 0.943 . . . . 75.53 109.181 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 86.0 mtp 73.31 160.09 0.23 Allowed 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.834 1.654 . . . . 75.24 113.194 172.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.49 148.01 47.21 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.05 -1.093 . . . . 71.25 108.05 168.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -67.23 -28.14 67.81 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 118.661 0.664 . . . . 75.4 112.159 -178.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.35 -46.09 77.97 Favored 'General case' 0 C--O 1.215 -0.757 0 O-C-N 123.481 0.488 . . . . 54.14 110.671 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.6 mmt -75.28 -28.64 59.83 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 123.833 0.708 . . . . 74.3 112.549 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -75.01 -48.96 21.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.632 0.773 . . . . 73.5 111.503 -173.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.91 -28.18 62.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.326 -0.397 . . . . 75.12 111.8 177.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.1 tp -64.97 -38.89 92.46 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.899 -0.591 . . . . 72.3 110.551 171.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.94 -28.42 68.27 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.355 1.062 . . . . 74.43 112.655 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -60.17 -39.54 86.82 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 123.671 0.607 . . . . 72.2 110.735 173.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -79.78 -30.58 40.67 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.063 -0.517 . . . . 73.11 111.336 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.411 ' O ' HG12 ' A' ' 49' ' ' ILE . 73.2 m -70.45 -37.39 74.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.707 0.403 . . . . 72.34 111.189 -177.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.53 -31.9 63.92 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 111.406 0.15 . . . . 74.13 111.406 173.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.75 -31.54 71.53 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.666 0.604 . . . . 75.13 112.123 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.536 ' HZ3' HD22 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -87.31 -22.07 25.35 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.769 0.655 . . . . 75.21 112.769 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 45' ' ' THR . 35.6 pt -95.23 -12.29 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.389 0.541 . . . . 74.23 112.279 178.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.36 -44.13 87.11 Favored Pre-proline 0 CA--C 1.561 1.369 0 N-CA-C 113.828 1.047 . . . . 74.32 113.828 173.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -71.96 -10.97 26.94 Favored 'Trans proline' 0 C--N 1.38 2.207 0 CA-C-N 121.767 1.667 . . . . 61.22 113.868 170.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 86.4 mt -91.57 156.15 17.86 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.99 -0.374 . . . . 74.41 109.99 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p -92.43 -178.24 4.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.045 -0.525 . . . . 72.44 109.903 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.484 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -78.27 -25.01 46.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.35 -0.386 . . . . 74.53 111.018 175.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.87 -32.89 59.91 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 122.807 0.443 . . . . 75.31 111.799 173.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.62 -47.98 79.19 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.115 0.259 . . . . 71.43 110.641 173.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.85 -23.87 63.35 Favored 'General case' 0 C--O 1.21 -0.996 0 O-C-N 123.781 0.676 . . . . 74.35 111.931 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.8 -35.97 75.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.884 0.765 . . . . 71.12 111.616 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -82.68 -24.04 33.88 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.088 -0.506 . . . . 74.21 111.903 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.1 mt -101.66 16.01 27.13 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.239 0.615 . . . . 74.03 112.263 -175.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -82.78 97.39 8.57 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.228 -0.442 . . . . 42.23 110.446 -176.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mp 58.19 78.81 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 125.157 1.536 . . . . 73.03 110.391 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -100.05 -23.43 14.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.832 -1.076 . . . . 74.24 111.107 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.53 ' H ' HG21 ' A' ' 9' ' ' THR . . . -148.05 80.86 1.48 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.104 0.478 . . . . 73.34 111.048 -177.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.304 0 CA-C-N 116.01 -0.541 . . . . 75.13 111.22 179.814 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.525 ' H ' ' HZ ' ' A' ' 63' ' ' PHE . 66.0 mt . . . . . 0 N--CA 1.451 -0.384 0 N-CA-C 109.159 -0.682 . . . . 73.41 109.159 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 34.0 p -84.73 -177.25 6.54 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.481 0.178 . . . . 71.44 111.481 -178.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.743 HD12 ' HB2' ' A' ' 64' ' ' ALA . 15.7 mm -64.26 -36.42 77.03 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.361 -0.382 . . . . 74.22 110.171 177.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -69.03 -46.35 68.15 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.742 0.417 . . . . 75.51 111.546 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.534 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 43.9 mt-10 -68.35 -43.64 77.02 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.982 0.801 . . . . 73.04 111.399 -175.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.483 ' HB ' ' O ' ' A' ' 64' ' ' ALA . 9.1 m -74.56 -29.68 61.44 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 122.659 0.384 . . . . 74.23 111.747 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -64.75 -42.56 95.08 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.6 0.36 . . . . 72.53 110.8 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.516 HD23 ' HA ' ' A' ' 42' ' ' ALA . 7.0 tp -61.83 -41.8 98.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.99 0.916 . . . . 64.43 111.606 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.798 HD21 HD21 ' A' ' 23' ' ' LEU . 65.9 mt -68.64 -31.25 70.25 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 116.204 -0.453 . . . . 74.05 111.296 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.6 t -70.53 -24.3 62.79 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.609 0.764 . . . . 72.31 111.751 176.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.0 mt -78.03 -42.4 27.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 122.53 0.332 . . . . 74.13 110.717 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -106.78 11.64 29.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.602 0.593 . . . . 63.44 112.602 -173.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -58.45 103.23 0.14 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.385 1.074 . . . . 73.24 111.761 175.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -101.6 -75.65 0.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.373 -0.83 . . . . 63.11 110.223 177.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.92 74.45 0.44 Allowed Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.416 -0.674 . . . . 71.42 111.416 -175.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.79 -136.84 19.12 Favored Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 110.874 -0.89 . . . . 71.11 110.874 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.88 -23.11 18.89 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 120.55 0.214 . . . . 75.45 110.857 173.275 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -74.42 -49.91 20.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.791 -0.641 . . . . 74.42 110.371 -176.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.04 -29.94 75.98 Favored Glycine 0 C--N 1.337 0.585 0 O-C-N 123.457 0.473 . . . . 74.31 112.434 172.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.798 HD21 HD21 ' A' ' 12' ' ' LEU . 63.6 tp -61.68 -43.49 98.76 Favored 'General case' 0 C--O 1.218 -0.596 0 C-N-CA 123.275 0.63 . . . . 74.35 110.949 174.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.412 ' HG2' HD13 ' A' ' 46' ' ' LEU . 55.8 mtt -70.08 -40.21 75.15 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.245 0.341 . . . . 73.41 111.81 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.75 -39.59 93.89 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.374 0.421 . . . . 74.5 111.64 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -72.86 -40.27 65.81 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 115.946 -0.57 . . . . 74.25 110.921 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.442 HG23 ' HE2' ' A' ' 34' ' ' MET . 32.6 mt -67.38 -46.33 83.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 119.155 -0.45 . . . . 74.21 112.192 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -67.35 -25.24 65.89 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.098 0.777 . . . . 75.42 113.098 -176.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.89 -35.42 24.13 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.476 0.176 . . . . 72.04 111.476 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.542 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.45 16.07 22.86 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 113.078 0.77 . . . . 73.33 113.078 -172.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.8 mt -53.44 -51.18 78.15 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 114.373 1.249 . . . . 74.3 114.373 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.53 -23.52 57.36 Favored 'Trans proline' 0 C--N 1.38 2.22 0 CA-C-N 121.834 1.691 . . . . 74.13 113.409 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.542 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 15.0 m-85 -92.7 10.84 28.95 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.109 0.563 . . . . 73.52 111.127 -173.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.442 ' HE2' HG23 ' A' ' 27' ' ' ILE . 62.8 mtt -99.17 16.29 23.28 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.009 -0.541 . . . . 73.4 111.823 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.29 -77.05 0.06 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.956 1.302 . . . . 73.52 111.976 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.65 -53.91 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.199 0.6 . . . . 74.22 109.728 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -70.48 -36.07 73.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 123.682 0.614 . . . . 71.11 112.049 -172.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 16.2 mmt -74.36 -29.57 61.62 Favored 'General case' 0 C--O 1.213 -0.82 0 O-C-N 123.363 0.415 . . . . 74.54 111.461 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -70.9 -52.5 19.7 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.45 0.3 . . . . 74.42 111.584 -177.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -66.64 -36.21 82.01 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.818 -0.628 . . . . 75.41 111.395 -176.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.427 HD13 ' HG2' ' A' ' 8' ' ' GLU . 27.7 tp -70.57 -34.81 72.62 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.8 -0.636 . . . . 75.24 111.02 177.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.516 ' HA ' HD23 ' A' ' 11' ' ' LEU . . . -66.96 -37.78 84.89 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 112.611 0.597 . . . . 61.44 112.611 -177.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -73.17 -33.59 65.52 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.004 0.19 . . . . 74.22 111.43 178.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -67.58 -43.11 81.36 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.518 0.511 . . . . 72.43 111.324 174.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.462 ' O ' HG13 ' A' ' 49' ' ' ILE . 21.8 m -76.53 -30.59 57.19 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.173 -0.467 . . . . 73.14 111.274 -177.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.412 HD13 ' HG2' ' A' ' 24' ' ' MET . 12.7 mt -69.98 -30.1 67.36 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 118.724 0.693 . . . . 72.34 112.035 175.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.54 -19.31 60.94 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.362 0.414 . . . . 72.14 111.291 173.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -88.76 -24.31 22.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.009 0.523 . . . . 74.33 111.365 177.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.496 HG23 HD13 ' A' ' 52' ' ' LEU . 15.4 mt -94.09 -8.53 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.322 0.582 . . . . 75.24 109.771 175.191 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.8 -41.48 77.49 Favored Pre-proline 0 CA--C 1.557 1.243 0 CA-C-O 118.026 -0.988 . . . . 71.23 113.509 174.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.47 1.71 8.5 Favored 'Trans proline' 0 C--N 1.381 2.278 0 CA-C-N 121.677 1.635 . . . . 75.23 114.124 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.496 HD13 HG23 ' A' ' 49' ' ' ILE . 54.0 mt -96.73 169.31 9.96 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.976 -0.379 . . . . 75.35 109.976 176.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 16.9 p -105.67 -170.64 1.77 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.013 -0.54 . . . . 72.41 109.798 168.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -23.35 44.74 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.767 -0.457 . . . . 73.4 109.767 171.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -66.23 -46.3 77.68 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.798 0.839 . . . . 73.41 109.52 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.428 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 17.6 mm-40 -67.18 -29.54 69.25 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.883 0.74 . . . . 75.51 112.986 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.443 ' HH ' HD23 ' A' ' 23' ' ' LEU . 66.9 t80 -74.73 -36.7 62.65 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 110.43 -0.211 . . . . 75.5 110.43 176.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.64 -14.98 60.39 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.156 0.428 . . . . 62.14 112.156 177.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.51 -42.96 82.0 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 122.191 0.196 . . . . 74.41 111.309 172.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.521 ' HB2' ' CD1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -86.45 -44.96 11.59 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 120.939 -0.304 . . . . 73.21 111.36 178.111 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.3 34.41 22.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.292 1.437 . . . . 65.1 114.44 166.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.3 mm 67.02 93.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 122.452 1.12 . . . . 73.12 109.904 -173.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.525 ' HZ ' ' H ' ' A' ' 4' ' ' LEU . 21.6 p90 -117.35 -2.58 11.55 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.084 -1.417 . . . . 73.15 111.592 -171.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.743 ' HB2' HD12 ' A' ' 6' ' ' ILE . . . -153.82 75.31 1.03 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.09 0.471 . . . . 71.31 111.527 -173.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.397 -0.365 . . . . 73.54 111.068 177.434 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.745 HD12 ' HZ1' ' A' ' 48' ' ' LYS . 58.3 mt . . . . . 0 CA--C 1.506 -0.745 0 CA-C-O 120.599 0.238 . . . . 75.52 110.623 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.409 HG22 ' HG3' ' A' ' 8' ' ' GLU . 11.5 t -82.0 166.33 19.91 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.436 -0.802 . . . . 74.44 109.448 -174.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.428 ' HA ' ' O ' ' A' ' 64' ' ' ALA . 21.9 mm -59.7 -33.06 50.85 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 O-C-N 123.663 0.602 . . . . 74.31 110.951 -177.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -70.6 -38.91 74.05 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.416 0.895 . . . . 73.31 113.416 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.417 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 48.4 mt-10 -68.17 -41.06 82.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.08 0.467 . . . . 72.51 110.889 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.626 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.7 m -74.61 -29.07 61.17 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.127 -0.942 . . . . 53.21 111.468 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -65.45 -38.81 90.95 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.399 0.68 . . . . 73.43 110.688 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.499 HD22 ' HA ' ' A' ' 42' ' ' ALA . 59.9 tp -65.34 -33.67 76.51 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.897 -0.592 . . . . 74.15 110.939 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 77.9 mt -66.07 -36.84 84.29 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.899 -0.591 . . . . 62.23 110.801 173.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 m -65.07 -23.63 67.22 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.288 0.477 . . . . 61.15 112.288 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.9 mt -85.19 -39.83 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 111.677 0.251 . . . . 65.24 111.677 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -120.24 0.81 10.72 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.804 1.409 . . . . 75.12 114.804 -166.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.465 ' HB2' HD21 ' A' ' 23' ' ' LEU . 4.3 t30 -86.65 121.78 29.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.448 0.567 . . . . 72.23 110.15 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.28 -14.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.843 -0.343 . . . . 71.44 111.873 173.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.56 61.9 0.32 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.483 -0.865 . . . . 61.34 113.573 -173.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.59 -161.53 51.49 Favored Glycine 0 C--O 1.225 -0.458 0 C-N-CA 121.442 -0.409 . . . . 63.25 113.372 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.898 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 54.5 tttt -75.06 -37.15 61.72 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 123.666 0.274 . . . . 75.41 111.432 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -65.23 -48.65 72.58 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-O 118.976 -0.535 . . . . 75.2 110.964 177.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.37 -35.92 91.72 Favored Glycine 0 C--O 1.222 -0.627 0 O-C-N 123.654 0.596 . . . . 53.33 112.858 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 16' ' ' ASN . 2.4 tm? -62.02 -50.67 71.11 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.443 0.697 . . . . 73.22 110.591 176.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.878 ' HG2' HD22 ' A' ' 46' ' ' LEU . 40.7 mtt -71.66 -40.49 69.63 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 112.615 0.598 . . . . 73.52 112.615 -175.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.97 -35.43 78.36 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.294 0.372 . . . . 70.52 111.255 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -66.6 -48.61 68.97 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 123.358 0.411 . . . . 72.22 109.957 175.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.485 HG21 ' HE1' ' A' ' 34' ' ' MET . 11.8 mt -61.88 -43.58 97.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 123.732 0.645 . . . . 73.43 112.255 -179.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -64.67 -36.46 84.34 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.467 0.543 . . . . 75.33 112.467 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.11 -27.47 54.05 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.547 -0.297 . . . . 62.15 111.696 178.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.529 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -102.8 15.02 30.52 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 112.864 0.69 . . . . 74.12 112.864 -175.233 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 79.2 mt -58.05 -47.47 98.81 Favored Pre-proline 0 CA--C 1.556 1.176 0 N-CA-C 113.681 0.993 . . . . 74.4 113.681 178.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -83.19 10.41 3.67 Favored 'Trans proline' 0 C--N 1.378 2.122 0 C-N-CA 121.849 1.699 . . . . 73.52 113.603 173.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.433 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 98.2 m-85 -109.81 -3.62 16.56 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.045 0.538 . . . . 74.42 110.217 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.529 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.1 mtt -91.7 174.39 7.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.514 -0.766 . . . . 71.05 110.877 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.66 166.55 23.38 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.99 -0.744 . . . . 72.22 108.99 163.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -73.8 -30.47 62.75 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.787 -0.571 . . . . 74.23 110.919 -178.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -72.26 -33.86 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.212 -0.449 . . . . 71.52 110.718 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.3 ttm -75.0 -27.5 60.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.724 -0.671 . . . . 71.55 110.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -75.7 -43.1 48.9 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.516 0.726 . . . . 74.11 111.923 -177.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -72.13 -29.02 63.65 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.658 -0.246 . . . . 73.33 110.994 174.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.96 -30.98 68.47 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 116.148 -0.478 . . . . 75.13 110.278 174.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.527 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -62.78 -43.32 99.11 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 123.004 0.522 . . . . 75.22 111.75 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -69.41 -33.9 73.67 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.365 0.416 . . . . 73.34 111.578 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -65.3 -42.94 92.54 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.347 -0.842 . . . . 65.05 110.727 176.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.783 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 90.6 m -74.24 -36.32 63.89 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.973 -1.012 . . . . 73.32 111.665 -178.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.878 HD22 ' HG2' ' A' ' 24' ' ' MET . 49.4 mt -69.43 -31.1 69.22 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.814 -0.553 . . . . 64.34 112.384 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.64 91.81 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.668 0.618 . . . . 65.43 112.668 -177.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.783 ' HE3' ' HA ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -88.93 -7.71 55.54 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.197 0.814 . . . . 74.45 113.197 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.46 HG23 ' HG3' ' A' ' 20' ' ' LYS . 49.8 mt -97.53 -20.83 5.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.964 0.412 . . . . 70.33 109.901 174.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -50.28 -43.69 79.09 Favored Pre-proline 0 CA--C 1.559 1.301 0 N-CA-C 115.64 1.718 . . . . 74.25 115.64 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -80.15 8.64 3.99 Favored 'Trans proline' 0 C--N 1.385 2.458 0 CA-C-N 122.289 1.853 . . . . 74.11 114.474 178.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 40.1 mt -100.48 145.73 27.92 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 110.172 -0.307 . . . . 73.11 110.172 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.5 t -98.15 29.01 3.7 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-O 121.502 0.667 . . . . 73.44 110.852 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.898 ' HG2' ' HB3' ' A' ' 20' ' ' LYS . 47.3 mt-10 83.35 -28.66 0.1 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 126.706 2.002 . . . . 72.35 112.85 172.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -72.4 -33.58 67.27 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.028 0.442 . . . . 74.41 110.931 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -76.97 -29.15 55.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.472 -0.785 . . . . 75.45 110.485 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -71.91 -29.64 64.54 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.402 -0.363 . . . . 74.4 110.848 173.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.47 80.68 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.973 0.416 . . . . 73.31 110.968 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.63 -32.2 65.72 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.921 -1.036 . . . . 65.33 111.117 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.4 mt -86.5 -82.24 0.21 Allowed 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.074 -0.343 . . . . 72.22 110.074 176.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.34 -131.06 2.14 Favored 'General case' 0 C--N 1.35 0.626 0 C-N-CA 125.224 1.41 . . . . 74.14 111.537 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.4 mp -92.66 88.19 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.495 -0.928 . . . . 75.13 108.495 178.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.513 ' HE1' HD13 ' A' ' 4' ' ' LEU . 19.0 p90 -110.04 -32.54 6.98 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.454 -0.794 . . . . 75.45 111.36 -178.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.626 ' H ' HG21 ' A' ' 9' ' ' THR . . . -133.81 64.96 1.59 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.63 0.729 . . . . 72.32 111.235 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-O 121.779 0.799 . . . . 73.41 110.259 176.778 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.9 mt . . . . . 0 CA--C 1.509 -0.613 0 N-CA-C 109.508 -0.553 . . . . 65.21 109.508 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.1 p -81.47 163.63 22.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.347 -0.541 . . . . 71.23 109.775 173.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.505 HG23 ' HB1' ' A' ' 64' ' ' ALA . 31.0 mm -67.62 -29.17 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 116.006 -0.543 . . . . 70.23 111.135 -174.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -70.86 -37.43 73.1 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.966 -0.561 . . . . 73.45 110.974 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.604 0.594 . . . . 71.15 112.604 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.739 ' HB ' ' HB2' ' A' ' 64' ' ' ALA . 3.4 m -74.88 -29.32 60.97 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.738 0.304 . . . . 74.34 110.647 178.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.446 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.5 t-20 -67.61 -38.89 84.61 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.096 -0.335 . . . . 74.55 110.096 171.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.752 HD21 ' HA ' ' A' ' 42' ' ' ALA . 19.1 tp -60.71 -38.54 85.41 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.984 0.913 . . . . 74.55 111.64 175.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.5 mt -66.77 -32.72 74.19 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.836 -0.62 . . . . 74.51 111.423 174.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 t -72.0 -29.04 63.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.243 0.617 . . . . 75.53 112.081 177.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.662 HD13 ' HA ' ' A' ' 11' ' ' LEU . 71.8 mt -66.44 -42.69 90.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.119 0.568 . . . . 75.4 110.051 178.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.529 ' HH ' ' HG3' ' A' ' 34' ' ' MET . 75.9 m-85 -111.03 35.28 3.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.809 -0.632 . . . . 74.53 110.91 -175.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -83.31 103.7 12.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.482 0.658 . . . . 64.01 111.815 -172.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.473 ' HG2' HD21 ' A' ' 26' ' ' ASN . 4.7 pt-20 -142.3 122.2 13.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.793 -1.094 . . . . 64.44 110.122 171.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.04 -96.65 2.0 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.66 -0.7 . . . . 73.23 111.762 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.25 -131.28 1.2 Allowed Glycine 0 C--O 1.216 -0.973 0 N-CA-C 110.667 -0.973 . . . . 55.11 110.667 178.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -64.46 -46.18 84.19 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.63 0.772 . . . . 74.11 111.034 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -71.03 -47.89 56.09 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 123.372 0.42 . . . . 74.15 111.047 -175.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.65 -29.58 75.45 Favored Glycine 0 C--N 1.336 0.53 0 O-C-N 123.868 0.73 . . . . 72.22 113.531 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -43.83 98.25 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.468 0.307 . . . . 73.52 111.097 171.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.814 ' HG2' HD23 ' A' ' 46' ' ' LEU . 49.2 mtt -68.72 -38.63 80.36 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.335 0.397 . . . . 74.4 111.004 177.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.06 -44.99 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.171 0.434 . . . . 73.43 112.171 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.473 HD21 ' HG2' ' A' ' 17' ' ' GLU . 28.2 t-20 -69.48 -43.47 73.12 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.584 0.553 . . . . 63.11 110.576 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.466 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 30.9 mt -63.78 -48.19 87.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 119.12 -0.467 . . . . 71.24 111.972 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.7 -30.47 67.05 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.695 0.628 . . . . 74.41 112.695 -176.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.93 -33.72 66.12 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.033 0.208 . . . . 74.11 111.011 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.591 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -95.84 7.57 45.95 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.792 0.664 . . . . 51.24 112.792 -176.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 49.3 mt -60.93 -44.7 95.59 Favored Pre-proline 0 N--CA 1.481 1.119 0 N-CA-C 113.954 1.094 . . . . 64.33 113.954 178.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -65.35 -19.59 61.7 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.023 1.815 . . . . 74.21 114.312 174.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.591 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 20.2 m-85 -96.94 -10.49 26.25 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.713 0.292 . . . . 75.15 110.395 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.529 ' HG3' ' HH ' ' A' ' 15' ' ' TYR . 25.3 ttm -86.35 143.23 27.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 72.01 110.718 -171.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.42 145.56 51.29 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.851 0.719 . . . . 74.42 109.413 172.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -60.06 -30.58 69.3 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.887 1.069 . . . . 74.34 113.887 -173.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -70.06 -44.61 68.81 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.02 0.438 . . . . 64.31 110.704 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.1 ttm -74.5 -29.65 61.5 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.133 -0.939 . . . . 72.2 111.292 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.4 ttt180 -69.26 -44.89 70.99 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.736 0.814 . . . . 73.45 111.729 -178.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.53 -33.2 70.91 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 116.305 -0.407 . . . . 74.33 111.176 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.2 tp -67.91 -40.09 83.46 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.862 -0.608 . . . . 72.44 110.431 175.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.752 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -60.92 -45.08 96.07 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.91 0.884 . . . . 72.12 113.125 -176.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -66.48 -30.16 70.44 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.469 0.481 . . . . 72.23 112.094 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 -76.6 -33.48 58.43 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 123.128 0.267 . . . . 73.13 111.532 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.3 m -71.37 -31.3 67.15 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.569 0.348 . . . . 71.01 110.505 174.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.814 HD23 ' HG2' ' A' ' 24' ' ' MET . 63.1 mt -68.61 -30.27 68.97 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 122.642 0.377 . . . . 74.44 111.379 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.12 61.35 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 123.21 0.319 . . . . 71.34 111.639 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -84.43 -37.16 21.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.701 0.401 . . . . 62.11 111.8 175.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.78 -9.31 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 112.7 0.63 . . . . 61.12 112.7 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.4 -48.96 96.42 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.911 -1.042 . . . . 75.11 113.54 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.63 -4.81 15.42 Favored 'Trans proline' 0 C--N 1.385 2.468 0 CA-C-N 121.646 1.623 . . . . 73.24 113.977 176.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 43.6 mt -89.26 145.95 25.06 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.654 -0.499 . . . . 73.14 109.654 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.44 HG23 ' H ' ' A' ' 56' ' ' GLU . 11.5 t -83.62 163.24 20.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.741 -0.663 . . . . 72.22 109.805 172.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -61.53 -39.65 91.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.019 0.928 . . . . 73.21 111.477 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.9 -35.49 76.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.834 -0.621 . . . . 74.05 112.323 -176.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.44 ' H ' HG23 ' A' ' 53' ' ' THR . 39.2 tt0 -75.87 -33.54 59.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 123.248 0.342 . . . . 72.43 111.033 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -69.89 -30.64 68.13 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.026 0.204 . . . . 75.02 111.034 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.43 -24.2 63.8 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.044 0.387 . . . . 74.5 112.044 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -76.0 -27.29 57.35 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.251 -0.431 . . . . 72.53 111.294 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.48 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.8 mt -81.53 -55.32 4.75 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.922 -0.581 . . . . 71.24 110.757 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.88 -110.3 0.55 Allowed 'General case' 0 C--N 1.348 0.503 0 O-C-N 125.114 1.509 . . . . 73.15 110.183 -168.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.4 HG23 HG23 ' A' ' 9' ' ' THR . 48.3 mm -121.47 105.43 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.111 -0.7 . . . . 72.14 109.111 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.48 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 2.7 m-85 -97.48 24.16 6.9 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.026 -0.534 . . . . 73.23 111.813 178.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.739 ' HB2' ' HB ' ' A' ' 9' ' ' THR . . . -148.96 -149.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.315 -0.402 . . . . 70.04 110.114 -177.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.225 0 C-N-CA 125.348 1.459 . . . . 64.33 112.435 178.704 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.488 HD21 ' HG2' ' A' ' 8' ' ' GLU . 76.6 mt . . . . . 0 C--O 1.238 0.464 0 N-CA-C 108.395 -0.965 . . . . 74.54 108.395 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 15.3 t -98.67 173.52 6.86 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 109.244 -0.65 . . . . 71.25 109.244 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.4 HG22 ' HB3' ' A' ' 64' ' ' ALA . 10.7 mm -60.32 -24.94 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.953 1.301 . . . . 74.44 112.192 -175.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.89 -37.79 70.09 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.724 0.809 . . . . 72.22 112.564 -178.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.488 ' HG2' HD21 ' A' ' 4' ' ' LEU . 1.3 mp0 -63.74 -43.96 94.94 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.174 0.512 . . . . 72.32 110.943 178.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.419 ' HA ' ' HG ' ' A' ' 12' ' ' LEU . 6.7 p -74.96 -25.36 58.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.659 -1.155 . . . . 64.34 112.666 178.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.468 ' O ' HG13 ' A' ' 14' ' ' ILE . 4.0 t-20 -66.52 -33.51 75.83 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.916 0.486 . . . . 64.13 111.151 174.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.414 ' HA ' HD13 ' A' ' 14' ' ' ILE . 58.7 tp -62.91 -33.96 76.42 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 122.816 0.446 . . . . 74.21 110.891 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.81 HD21 HD21 ' A' ' 23' ' ' LEU . 13.8 mt -71.46 -38.61 71.27 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.517 -0.765 . . . . 72.01 110.433 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.6 p -72.04 -22.19 61.42 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.785 0.661 . . . . 74.04 112.785 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 10' ' ' ASN . 99.3 mt -60.88 -47.42 93.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.78 0.324 . . . . 73.31 110.218 174.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -91.91 -78.09 0.41 Allowed 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.22 -0.445 . . . . 72.24 110.947 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.6 t30 52.96 71.34 0.49 Allowed 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.727 1.267 . . . . 73.33 110.094 -172.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -140.31 123.25 16.53 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.495 -1.229 . . . . 73.3 109.818 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.34 21.24 79.46 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 115.272 0.869 . . . . 75.11 115.272 168.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.71 -140.49 29.17 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 121.294 -0.479 . . . . 72.32 112.595 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.787 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -76.8 -33.68 57.98 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 123.745 0.32 . . . . 64.32 111.307 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 38.6 mtt180 -65.28 -61.42 2.13 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 119.427 -0.321 . . . . 71.41 110.96 177.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.28 -30.82 78.71 Favored Glycine 0 C--O 1.214 -1.111 0 O-C-N 124.56 1.163 . . . . 42.33 113.924 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.81 HD21 HD21 ' A' ' 12' ' ' LEU . 26.3 tp -65.18 -48.86 71.96 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 117.317 0.558 . . . . 73.24 110.632 177.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.0 mtp -69.95 -36.79 75.55 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 123.423 0.452 . . . . 74.41 111.435 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 62.4 mm-40 -68.74 -39.86 80.12 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.269 0.355 . . . . 74.51 111.779 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -69.59 -42.77 74.0 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 119.382 -0.342 . . . . 73.33 111.397 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.633 HG22 ' HE2' ' A' ' 34' ' ' MET . 40.3 mt -62.88 -43.73 99.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 O-C-N 123.784 0.677 . . . . 75.24 112.051 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.25 -39.79 95.61 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.06 0.763 . . . . 74.33 113.06 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.71 29.67 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.83 0.678 . . . . 71.52 112.83 -177.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.653 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -114.47 19.39 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.14 0.793 . . . . 63.34 113.14 -171.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 39.3 mt -51.0 -52.58 56.81 Favored Pre-proline 0 CA--C 1.552 1.049 0 N-CA-C 114.117 1.154 . . . . 72.3 114.117 174.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.48 -15.1 41.3 Favored 'Trans proline' 0 C--N 1.382 2.327 0 C-N-CA 121.777 1.651 . . . . 75.12 114.101 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.653 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 55.6 m-85 -96.58 -1.27 47.32 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.278 0.231 . . . . 74.32 111.452 -175.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.633 ' HE2' HG22 ' A' ' 27' ' ' ILE . 66.6 mtt -78.19 -77.82 0.15 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.941 0.4 . . . . 73.32 111.548 178.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -162.88 -90.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.107 -0.951 . . . . 62.22 109.136 -167.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 176.18 -51.92 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.765 1.226 . . . . 74.24 108.218 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -73.69 -38.08 64.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.248 -0.887 . . . . 63.11 109.366 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' MET . . . . . 0.465 ' HE1' HD11 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -62.47 -25.69 68.13 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.628 -1.169 . . . . 73.13 113.237 178.096 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -62.56 -52.6 62.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.138 0.575 . . . . 75.04 111.202 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -68.88 -36.19 77.78 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.441 0.696 . . . . 73.3 111.551 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 8' ' ' GLU . 61.4 tp -59.64 -38.08 80.42 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.581 1.153 . . . . 73.33 111.807 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.29 82.66 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 124.121 0.888 . . . . 73.34 113.273 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -60.34 -40.82 92.04 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.704 0.628 . . . . 75.31 111.856 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 44' ' ' ARG . 48.0 mtm105 -76.2 -35.18 59.19 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.631 0.604 . . . . 75.44 112.631 -178.597 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.436 HG23 HD22 ' A' ' 12' ' ' LEU . 1.7 m -79.11 -38.6 35.78 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.597 0.221 . . . . 74.21 111.597 -176.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -66.6 -31.09 71.57 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.273 0.472 . . . . 72.53 112.273 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.81 -23.71 64.3 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.638 0.586 . . . . 74.33 111.555 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -88.56 -28.3 20.82 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.256 -0.429 . . . . 75.04 112.033 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.421 ' HA ' HD11 ' A' ' 52' ' ' LEU . 35.6 mt -93.01 -21.11 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 110.703 -0.11 . . . . 71.33 110.703 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.43 -47.58 95.75 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 114.687 1.365 . . . . 72.51 114.687 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.16 5.64 6.11 Favored 'Trans proline' 0 C--N 1.383 2.346 0 CA-C-N 121.902 1.715 . . . . 72.32 114.385 176.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 49' ' ' ILE . 96.1 mt -98.75 168.19 10.3 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.502 -0.555 . . . . 74.33 109.502 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.434 ' OG1' ' HG2' ' A' ' 56' ' ' GLU . 63.5 p -102.96 -179.81 4.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.753 -0.462 . . . . 74.41 109.753 173.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.787 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -75.11 -22.71 58.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.858 -0.61 . . . . 63.52 110.721 174.336 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -74.39 -35.77 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.442 -0.799 . . . . 75.15 110.489 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.434 ' HG2' ' OG1' ' A' ' 53' ' ' THR . 21.5 mm-40 -70.9 -39.22 72.88 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.242 -0.436 . . . . 63.13 110.876 176.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -70.05 -28.21 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.173 -0.467 . . . . 74.04 111.045 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.19 -28.55 68.19 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 111.836 0.31 . . . . 74.32 111.836 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.43 -30.23 64.42 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.459 0.303 . . . . 73.31 111.792 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.6 mt -79.01 -54.39 6.07 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.749 -0.463 . . . . 75.24 109.749 -178.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 52.21 42.93 31.0 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 125.214 1.571 . . . . 75.24 112.975 174.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.432 HG13 ' HB2' ' A' ' 12' ' ' LEU . 3.2 mp 68.98 112.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.981 0.912 . . . . 75.34 109.368 -168.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.68 -31.43 19.74 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.339 -0.846 . . . . 74.52 111.298 -171.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.4 ' HB3' HG22 ' A' ' 6' ' ' ILE . . . -154.42 128.26 8.78 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.024 0.44 . . . . 74.03 111.459 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.844 -0.616 . . . . 73.41 110.231 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.58 HD11 ' HD2' ' A' ' 48' ' ' LYS . 90.4 mt . . . . . 0 N--CA 1.449 -0.504 0 CA-C-O 120.812 0.339 . . . . 62.41 110.935 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.459 HG23 ' HG2' ' A' ' 8' ' ' GLU . 8.2 t -90.27 169.66 10.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 115.475 -0.784 . . . . 61.05 108.889 167.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.1 mm -63.38 -32.02 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.414 0.686 . . . . 74.41 112.203 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -71.52 -24.28 61.93 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.57 0.581 . . . . 73.3 112.57 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.48 ' HB3' HG23 ' A' ' 45' ' ' THR . 32.5 mm-40 -63.82 -52.53 59.75 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.492 0.663 . . . . 74.12 110.307 176.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -26.4 61.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.648 -1.16 . . . . 75.41 112.25 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -66.92 -39.59 87.4 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.733 0.413 . . . . 75.2 111.152 172.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.639 HD22 ' HA ' ' A' ' 42' ' ' ALA . 27.6 tp -69.43 -37.12 77.27 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.296 0.638 . . . . 72.22 111.153 175.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.7 mt -66.11 -32.06 73.3 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.932 -0.576 . . . . 75.33 111.743 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.1 t -65.75 -32.58 74.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.798 0.687 . . . . 64.01 111.292 177.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 62.6 mt -67.08 -36.66 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 123.3 0.64 . . . . 62.13 110.854 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -116.59 28.5 8.52 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 71.5 112.303 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -83.44 95.76 8.35 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.41 -0.359 . . . . 74.3 110.948 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -166.4 136.06 3.17 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.932 -0.576 . . . . 70.21 110.007 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.38 23.68 60.34 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 115.316 0.886 . . . . 74.42 115.316 169.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 -144.5 31.33 Favored Glycine 0 C--O 1.222 -0.631 0 CA-C-N 117.216 0.508 . . . . 63.22 112.331 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -79.25 -36.92 39.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.523 0.329 . . . . 75.45 110.702 176.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -64.8 -47.84 76.61 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.321 -0.399 . . . . 75.31 110.903 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.68 -35.56 90.01 Favored Glycine 0 C--O 1.219 -0.822 0 CA-C-O 119.326 -0.708 . . . . 61.33 112.773 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.91 -47.19 83.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.939 0.495 . . . . 71.13 111.172 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.441 ' HG2' HD23 ' A' ' 46' ' ' LEU . 42.9 mtt -68.98 -35.59 76.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.792 -0.64 . . . . 71.12 112.133 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -72.57 -33.56 66.87 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.01 0.374 . . . . 74.34 112.01 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -71.03 -37.63 72.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.658 0.383 . . . . 71.41 111.383 176.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.29 -41.95 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 116.211 -0.45 . . . . 71.42 111.349 178.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -70.25 -28.97 65.66 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.92 0.711 . . . . 65.3 112.92 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.23 -28.49 62.19 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.597 0.237 . . . . 72.42 111.306 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.551 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.27 17.83 22.38 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.285 -0.416 . . . . 65.14 112.072 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.9 mt -68.33 -40.77 21.69 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-O 117.925 -1.036 . . . . 74.11 112.968 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.13 -3.0 12.46 Favored 'Trans proline' 0 C--N 1.382 2.305 0 CA-C-N 121.778 1.671 . . . . 74.23 113.885 168.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.551 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.0 m-85 -109.29 -164.01 0.91 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.201 0.6 . . . . 71.24 110.021 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.4 mtm 65.9 -169.9 0.2 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 125.035 1.334 . . . . 74.42 111.776 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -76.05 163.29 27.28 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.775 -0.648 . . . . 73.32 109.683 167.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -73.82 -24.73 59.83 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.726 -0.472 . . . . 73.02 109.726 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -66.09 -44.35 84.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.749 -0.659 . . . . 73.51 110.537 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' MET . . . . . 0.437 ' HG3' HD12 ' A' ' 11' ' ' LEU . 3.2 tpt -75.99 -25.81 56.14 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.421 -0.809 . . . . 73.34 111.205 -178.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -70.86 -44.65 65.94 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.501 1.12 . . . . 74.34 111.4 177.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -68.65 -33.38 73.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.13 -0.487 . . . . 74.21 111.566 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -66.21 -37.72 86.26 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.601 -0.727 . . . . 65.33 110.643 175.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.639 ' HA ' HD22 ' A' ' 11' ' ' LEU . . . -60.68 -37.66 82.36 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 113.571 0.952 . . . . 70.13 113.571 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -78.71 -27.44 44.94 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.133 0.271 . . . . 74.15 111.662 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -36.09 74.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.586 0.354 . . . . 75.45 111.153 172.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.48 HG23 ' HB3' ' A' ' 8' ' ' GLU . 1.6 m -81.24 -25.19 36.84 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.902 0.382 . . . . 72.31 111.583 178.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.441 HD23 ' HG2' ' A' ' 24' ' ' MET . 29.5 mt -66.58 -27.35 67.65 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.982 -0.449 . . . . 73.32 111.608 168.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.75 -18.17 64.17 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.332 0.493 . . . . 75.1 112.332 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.58 ' HD2' HD11 ' A' ' 4' ' ' LEU . 65.3 tttt -70.23 -56.48 6.69 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 110.07 -0.344 . . . . 75.22 110.07 170.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.8 mt -85.39 -20.23 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 112.833 0.679 . . . . 73.11 112.833 -163.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.87 95.88 Favored Pre-proline 0 CA--C 1.557 1.228 0 N-CA-C 114.202 1.186 . . . . 72.45 114.202 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.47 -4.28 14.04 Favored 'Trans proline' 0 C--N 1.377 2.075 0 CA-C-N 121.565 1.595 . . . . 70.44 114.161 172.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 48' ' ' LYS . 78.6 mt -85.38 133.57 34.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.433 -0.58 . . . . 74.44 109.433 176.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -89.19 24.43 2.16 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.763 0.653 . . . . 74.52 112.763 -172.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 76.64 -48.55 0.55 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 126.21 1.804 . . . . 71.25 112.732 173.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -64.48 -37.01 86.06 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.69 0.757 . . . . 72.41 109.657 170.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -68.67 -35.03 76.7 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.382 -1.281 . . . . 73.25 111.32 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -72.47 -24.9 61.25 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.919 0.487 . . . . 74.24 111.313 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -22.57 61.73 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.88 0.696 . . . . 63.34 112.88 -177.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.03 -29.48 49.42 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.837 0.351 . . . . 74.34 111.009 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.9 mt -88.89 -66.99 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.656 -0.702 . . . . 74.43 110.829 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 48.68 -105.76 0.16 Allowed 'General case' 0 CA--C 1.536 0.442 0 O-C-N 125.439 1.712 . . . . 72.44 112.304 -174.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 22.1 mm -115.41 104.31 16.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.595 -0.891 . . . . 75.01 108.595 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -110.41 -3.27 16.19 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.026 -0.534 . . . . 74.01 112.033 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -150.08 79.67 1.36 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.213 0.53 . . . . 54.3 111.63 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.238 0.542 . . . . 65.03 110.389 173.526 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.76 0.314 . . . . 74.43 110.288 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.2 pt -86.63 163.49 2.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 CA-C-N 115.99 -0.55 . . . . 75.23 110.524 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -109.33 115.1 29.35 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.322 -0.621 . . . . 75.04 109.322 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 98.4 mt -105.99 155.44 19.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.074 -0.967 . . . . 75.12 110.749 176.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.4 p -82.41 175.15 10.46 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.22 -0.445 . . . . 75.54 111.043 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.46 -38.37 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.303 -0.408 . . . . 73.12 110.34 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.72 -44.61 95.78 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 122.903 0.481 . . . . 75.31 110.989 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.434 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 46.3 mt-10 -65.79 -51.49 58.65 Favored 'General case' 0 CA--C 1.526 0.035 0 O-C-N 124.194 0.934 . . . . 75.23 112.413 -176.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.0 m -74.18 -28.51 61.32 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 123.346 0.404 . . . . 71.02 111.759 -173.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -70.89 -32.92 70.04 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.385 -0.197 . . . . 74.04 111.437 176.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.45 HD11 HD12 ' A' ' 14' ' ' ILE . 54.8 tp -70.89 -35.52 72.36 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.621 0.248 . . . . 74.03 110.859 175.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.812 HD21 HD22 ' A' ' 23' ' ' LEU . 85.4 mt -67.07 -31.81 72.56 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 116.112 -0.495 . . . . 74.23 110.844 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -65.53 -25.3 67.39 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.841 0.857 . . . . 74.24 111.822 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.45 HD12 HD11 ' A' ' 11' ' ' LEU . 68.7 mt -72.54 -31.36 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 C-N-CA 123.213 0.605 . . . . 72.24 111.074 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -123.26 8.22 9.12 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 113.441 0.904 . . . . 72.53 113.441 -173.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.28 106.38 1.09 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.335 0.654 . . . . 72.44 112.316 -178.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -166.18 125.2 1.57 Allowed 'General case' 0 C--O 1.222 -0.384 0 O-C-N 124.127 0.892 . . . . 73.32 109.606 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.73 38.02 24.98 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.355 -0.45 . . . . 72.42 113.129 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.33 -147.66 36.25 Favored Glycine 0 C--N 1.334 0.468 0 N-CA-C 111.688 -0.565 . . . . 71.34 111.688 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.525 ' HZ3' ' HG3' ' A' ' 21' ' ' ARG . 2.9 pptp? -93.28 -18.76 22.08 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.429 0.157 . . . . 75.33 110.63 177.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.525 ' HG3' ' HZ3' ' A' ' 20' ' ' LYS . 18.5 mtp85 -65.93 -57.06 8.72 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.032 -0.531 . . . . 74.51 110.802 174.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.6 -29.0 74.17 Favored Glycine 0 C--O 1.209 -1.436 0 O-C-N 124.028 0.83 . . . . 62.13 112.659 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.812 HD22 HD21 ' A' ' 12' ' ' LEU . 26.3 tp -62.38 -44.57 96.14 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.191 0.596 . . . . 73.01 111.47 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.465 ' HG2' HD23 ' A' ' 46' ' ' LEU . 62.9 mtt -69.46 -36.7 76.84 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 122.514 0.326 . . . . 62.42 111.383 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 39.8 mm-40 -73.25 -30.91 63.79 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 123.29 0.369 . . . . 71.25 111.003 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -68.62 -47.77 65.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.154 0.582 . . . . 74.2 111.182 174.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.639 HG22 ' HE3' ' A' ' 34' ' ' MET . 44.7 mt -66.05 -48.11 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 O-C-N 123.647 0.592 . . . . 74.32 111.319 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.563 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 20.2 m-80 -70.61 -26.17 63.37 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.234 0.827 . . . . 75.43 113.234 -175.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.37 -28.09 41.92 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.688 0.28 . . . . 62.52 111.38 175.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.697 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -105.23 18.22 22.68 Favored 'General case' 0 C--O 1.221 -0.427 0 N-CA-C 112.18 0.437 . . . . 74.34 112.18 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.779 HD21 ' HG3' ' A' ' 39' ' ' ARG . 86.6 mt -60.19 -47.51 96.58 Favored Pre-proline 0 CA--C 1.554 1.119 0 N-CA-C 113.478 0.918 . . . . 74.33 113.478 176.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.07 -14.48 35.15 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.824 1.683 . . . . 74.22 113.747 175.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.697 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 70.3 m-85 -94.98 -8.43 36.94 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.843 0.354 . . . . 73.42 110.421 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.639 ' HE3' HG22 ' A' ' 27' ' ' ILE . 6.5 ttm -93.82 164.05 13.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.863 -0.608 . . . . 75.4 110.333 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.39 153.69 41.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.491 -0.777 . . . . 74.4 109.545 174.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.26 -41.6 97.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.983 0.364 . . . . 74.14 111.983 -179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.71 -34.78 72.3 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.867 0.365 . . . . 62.43 110.596 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.5 mtt -66.02 -36.52 83.49 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 115.65 -0.705 . . . . 74.4 112.328 174.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.779 ' HG3' HD21 ' A' ' 31' ' ' LEU . 48.8 ttp180 -74.49 -39.81 62.23 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.766 0.427 . . . . 72.34 111.661 -177.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -72.36 -29.04 63.42 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.831 0.348 . . . . 73.21 111.425 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.0 tp -72.09 -35.01 69.1 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.176 -0.466 . . . . 72.42 110.527 172.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.74 96.43 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 112.875 0.694 . . . . 62.15 112.875 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -70.18 -26.62 63.98 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.242 0.339 . . . . 73.3 111.849 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 -74.57 -42.37 58.88 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.437 0.295 . . . . 75.33 111.657 175.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.418 HG21 ' HB3' ' A' ' 8' ' ' GLU . 5.2 m -78.79 -33.6 46.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 73.05 112.213 -175.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.561 HD21 HD13 ' A' ' 27' ' ' ILE . 59.4 mt -69.85 -28.06 65.36 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 122.24 -0.288 . . . . 72.04 111.498 176.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.73 -17.62 62.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 122.564 0.346 . . . . 73.11 111.791 174.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -77.86 -32.26 51.9 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 122.471 0.308 . . . . 75.12 110.601 174.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.474 HG22 HD13 ' A' ' 52' ' ' LEU . 1.8 mt -98.94 -7.12 9.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.036 -0.529 . . . . 74.23 110.68 -175.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.29 -46.68 99.77 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-O 118.094 -0.955 . . . . 60.54 113.327 171.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.51 8.0 4.18 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.788 1.674 . . . . 72.41 114.294 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.474 HD13 HG22 ' A' ' 49' ' ' ILE . 78.1 mt -108.72 168.73 9.13 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.752 0.31 . . . . 72.21 110.81 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -110.37 -168.92 1.37 Allowed 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.159 -0.473 . . . . 74.34 110.602 174.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.466 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 2.9 mp0 -68.03 -29.0 67.88 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.927 0.491 . . . . 74.12 110.549 171.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.17 -45.99 71.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.435 0.694 . . . . 73.14 111.125 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -72.29 -33.58 67.52 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.347 0.499 . . . . 75.53 112.347 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.494 ' HD1' HD11 ' A' ' 60' ' ' LEU . 53.3 t80 -75.85 -25.08 55.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.094 0.247 . . . . 74.21 110.941 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.08 60.14 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.362 -0.211 . . . . 70.25 111.561 175.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.77 -32.96 58.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.423 0.289 . . . . 72.53 110.832 172.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.494 HD11 ' HD1' ' A' ' 57' ' ' TYR . 47.3 mt -70.8 -59.83 2.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.188 -0.671 . . . . 74.21 109.188 173.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.58 28.6 12.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.733 1.613 . . . . 73.1 113.832 171.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 33.1 mm 62.04 89.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.493 0 C-N-CA 124.562 1.145 . . . . 70.45 110.77 -171.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -97.03 -39.35 9.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.713 -1.131 . . . . 73.21 110.532 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -105.9 76.44 1.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.255 0.55 . . . . 64.4 112.364 -173.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -151.69 10.62 0.56 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.166 -0.925 . . . . 73.21 110.13 172.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -98.41 -17.91 18.56 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.705 0.764 . . . . 74.21 109.964 -176.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 49.7 mp0 -78.16 -23.28 47.77 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.816 -1.084 . . . . 74.24 111.414 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.5 m -93.03 -0.6 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 112.161 0.43 . . . . 73.31 112.161 -178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.7 mt -77.38 -23.8 50.68 Favored 'General case' 0 C--O 1.224 -0.273 0 N-CA-C 111.935 0.346 . . . . 70.3 111.935 -176.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -78.26 -7.65 57.44 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.47 0.544 . . . . 70.03 112.47 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -83.31 -33.41 25.93 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.784 0.434 . . . . 75.35 111.678 -174.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -133.6 -46.96 0.81 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 110.293 -0.262 . . . . 73.22 110.293 -177.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 69.52 95.58 0.07 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.285 1.434 . . . . 62.45 111.305 -170.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -82.06 123.55 29.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.799 -1.092 . . . . 72.42 108.055 171.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -68.47 110.13 4.02 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.808 0.693 . . . . 64.02 111.637 -173.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 114.48 -1.236 . . . . 74.0 109.968 -175.776 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.4 ttm . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 109.312 -0.625 . . . . 73.34 109.312 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.3 tt -78.49 142.34 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 115.837 -0.62 . . . . 75.2 111.496 -177.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 26.8 mmt180 -83.62 98.85 9.83 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.451 -0.795 . . . . 75.03 111.304 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.8 mt -109.27 140.41 42.94 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.131 -0.94 . . . . 71.31 109.513 174.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -82.57 174.63 10.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.379 -0.373 . . . . 74.31 111.093 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.1 mm -62.68 -34.47 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 123.932 0.77 . . . . 73.54 111.181 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -74.18 -33.43 63.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 122.749 0.419 . . . . 73.24 111.884 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.491 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 49.6 mt-10 -73.78 -37.99 64.81 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.471 -0.331 . . . . 72.41 111.181 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.7 p -74.29 -27.21 60.63 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.049 -0.523 . . . . 64.21 112.088 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.467 ' O ' HG12 ' A' ' 14' ' ' ILE . 23.9 t-20 -67.77 -37.56 82.25 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.935 0.494 . . . . 74.21 110.914 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.465 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 17.7 tp -63.4 -37.9 89.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.449 0.7 . . . . 74.13 111.228 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 57.4 mt -68.28 -35.99 78.69 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.404 -0.816 . . . . 63.13 110.595 174.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -70.22 -24.22 63.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.975 0.91 . . . . 60.4 112.303 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 10' ' ' ASN . 40.6 mm -61.14 -45.26 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.023 0.529 . . . . 73.35 110.049 175.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -104.64 -76.0 0.61 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.72 -0.673 . . . . 75.53 111.171 -172.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 65.1 t30 53.4 76.16 0.22 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.257 1.423 . . . . 72.41 112.284 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -153.51 128.74 9.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.208 -0.906 . . . . 62.31 110.216 -177.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.92 37.68 92.35 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 124.057 0.848 . . . . 65.32 114.44 172.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.54 -143.94 37.91 Favored Glycine 0 C--N 1.335 0.527 0 N-CA-C 111.947 -0.461 . . . . 73.13 111.947 -176.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.509 ' HB2' HD11 ' A' ' 49' ' ' ILE . 1.2 pptp? -92.77 -14.84 27.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.554 -0.535 . . . . 74.3 109.554 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -67.92 -52.64 33.92 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.051 -0.977 . . . . 72.21 110.081 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.77 -27.92 73.49 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.269 -0.878 . . . . 74.0 112.75 174.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -60.02 -42.77 95.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.845 0.323 . . . . 65.31 110.937 172.189 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.858 ' HG2' HD23 ' A' ' 46' ' ' LEU . 51.9 mtt -68.92 -37.55 79.0 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.252 0.345 . . . . 72.21 111.711 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -67.05 -39.88 87.01 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.559 0.537 . . . . 74.2 111.742 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -76.33 -32.88 58.94 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 112.306 0.484 . . . . 75.3 112.306 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 31.7 mt -71.36 -44.99 71.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-O 119.271 -0.395 . . . . 75.33 111.29 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.479 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 m-80 -67.65 -33.84 75.75 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.262 0.467 . . . . 75.4 112.262 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.8 -31.64 64.99 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.256 0.348 . . . . 74.22 111.523 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.739 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.35 20.26 19.17 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 112.907 0.706 . . . . 74.41 112.907 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.479 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 80.0 mt -55.9 -47.68 98.25 Favored Pre-proline 0 CA--C 1.555 1.139 0 N-CA-C 113.286 0.847 . . . . 73.5 113.286 175.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.55 3.6 7.6 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.164 1.451 . . . . 72.13 114.245 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.739 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.7 m-85 -103.41 -29.6 11.1 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.705 0.288 . . . . 73.03 110.765 -178.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.3 ptp -81.9 170.63 15.41 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.885 -0.783 . . . . 73.31 108.885 169.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.09 155.11 40.26 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.205 0.316 . . . . 64.52 110.451 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -68.03 -32.75 73.34 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 111.99 0.367 . . . . 73.03 111.99 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.79 -36.09 72.87 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.184 0.516 . . . . 65.44 111.091 175.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 6.5 tpt -72.52 -26.96 61.96 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.956 -1.02 . . . . 72.03 110.881 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -73.38 -39.33 65.2 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.237 1.015 . . . . 74.54 111.371 178.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.18 -35.29 79.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.475 -0.33 . . . . 74.13 111.188 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.61 -40.17 76.76 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.646 -0.706 . . . . 71.32 110.82 173.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.556 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -58.86 -45.24 90.58 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 124.078 0.951 . . . . 62.1 113.47 -175.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -67.37 -28.97 68.39 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.569 0.543 . . . . 75.54 111.828 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 78.5 mtp180 -78.95 -33.77 44.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.355 -0.384 . . . . 70.11 111.544 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.42 ' O ' HG12 ' A' ' 49' ' ' ILE . 17.7 m -73.82 -27.24 61.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 122.781 0.433 . . . . 75.21 110.46 175.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.858 HD23 ' HG2' ' A' ' 24' ' ' MET . 38.8 mt -68.72 -30.81 69.53 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 111.406 0.15 . . . . 75.45 111.406 172.137 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.15 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 120.852 0.358 . . . . 74.54 111.407 173.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 74.3 mmtt -78.33 -48.51 15.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 115.938 -0.573 . . . . 75.31 110.261 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.509 HD11 ' HB2' ' A' ' 20' ' ' LYS . 16.0 pt -81.97 -13.3 12.4 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 N-CA-C 113.21 0.818 . . . . 73.22 113.21 -176.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -43.06 -48.36 14.85 Favored Pre-proline 0 N--CA 1.486 1.36 0 N-CA-C 116.338 1.977 . . . . 73.04 116.338 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -82.59 27.62 0.6 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 CA-C-N 122.301 1.857 . . . . 74.31 115.386 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.9 mt -102.11 143.55 31.8 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.78 0.8 . . . . 74.21 111.887 177.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.609 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 22.7 m -101.62 26.31 7.49 Favored 'General case' 0 CA--C 1.56 1.363 0 CA-C-N 114.023 -1.444 . . . . 70.23 110.854 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 77.86 -51.26 0.51 Allowed 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 125.995 1.718 . . . . 74.01 112.652 173.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -70.11 -31.27 68.75 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.701 0.8 . . . . 53.24 110.986 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.609 ' OE1' ' HB ' ' A' ' 53' ' ' THR . 26.4 mp0 -67.53 -35.52 79.25 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.898 -0.592 . . . . 72.23 111.011 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -75.04 -27.25 59.97 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-N 115.807 -0.633 . . . . 75.4 110.335 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.07 -22.73 60.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 117.877 0.308 . . . . 73.11 111.461 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -79.17 -31.21 43.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.957 0.503 . . . . 73.53 111.634 175.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.7 mt -89.14 -51.66 5.47 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.565 -0.289 . . . . 63.15 110.586 -178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.68 -121.71 1.83 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.226 1.81 . . . . 73.44 111.878 178.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 24.3 mm -95.88 100.48 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.401 -1.333 . . . . 74.22 107.401 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -92.06 -26.32 18.37 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.677 -0.692 . . . . 75.51 112.112 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -139.77 88.07 2.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.536 0.684 . . . . 75.03 111.872 -179.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -122.97 16.93 10.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.51 0.671 . . . . 74.24 110.51 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -85.13 -32.06 22.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.595 -0.729 . . . . 72.02 111.092 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -93.29 1.19 57.1 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.927 0.343 . . . . 73.22 111.927 -177.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.9 m -86.57 -34.5 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 109.86 -0.422 . . . . 75.02 109.86 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.5 mt -92.69 113.63 25.96 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 107.932 -1.136 . . . . 73.43 107.932 174.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 71.64 156.84 0.17 Allowed 'General case' 0 N--CA 1.479 0.978 0 O-C-N 125.694 1.871 . . . . 75.35 109.679 -163.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 44.2 m170 78.12 -46.27 0.44 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 125.334 1.454 . . . . 74.24 113.14 177.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -105.47 -8.97 17.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.476 0.179 . . . . 74.45 110.794 173.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -104.09 96.92 6.98 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 109.671 -0.492 . . . . 75.31 109.671 178.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -160.02 151.55 19.83 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.391 -0.822 . . . . 73.32 109.638 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -90.4 164.51 14.28 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.601 -0.272 . . . . 73.21 110.719 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.351 -0.386 . . . . 75.23 110.25 -177.26 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.538 ' HG3' HD23 ' A' ' 60' ' ' LEU . 13.7 tmm? . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 108.821 -0.807 . . . . 73.31 108.821 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.703 HG22 ' H ' ' A' ' 3' ' ' ARG . 7.4 mt 57.12 -155.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.275 0 O-C-N 124.708 1.255 . . . . 73.31 108.699 -173.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.703 ' H ' HG22 ' A' ' 2' ' ' ILE . 5.3 mpt_? -111.21 31.58 5.97 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 120.806 -1.184 . . . . 75.43 109.642 169.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.436 HD22 HG21 ' A' ' 45' ' ' THR . 74.8 mt -70.02 126.37 29.49 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 114.683 -1.144 . . . . 74.31 110.142 175.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.2 166.97 20.9 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.227 -0.897 . . . . 73.44 109.848 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.485 HG22 HG13 ' A' ' 68' ' ' VAL . 31.5 mm -67.94 -24.13 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.17 0.588 . . . . 71.4 111.982 -174.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.23 -34.42 65.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.862 -0.608 . . . . 71.52 110.676 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 40.6 mt-10 -73.51 -37.14 65.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.454 0.471 . . . . 71.24 111.357 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -73.21 -27.66 61.74 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.496 0.498 . . . . 74.32 111.687 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.444 ' O ' HG12 ' A' ' 14' ' ' ILE . 9.0 t-20 -64.48 -40.07 94.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.003 0.521 . . . . 71.43 111.046 171.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.601 HD23 ' HA ' ' A' ' 42' ' ' ALA . 16.7 tp -60.7 -34.34 74.22 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.067 0.947 . . . . 73.32 111.561 175.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.706 HD22 HD23 ' A' ' 23' ' ' LEU . 40.0 mt -71.07 -35.81 72.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.627 -0.715 . . . . 71.24 110.572 178.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.603 ' HA ' HD11 ' A' ' 62' ' ' ILE . 17.1 t -71.23 -23.75 62.06 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.32 -0.854 . . . . 74.11 112.902 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 10' ' ' ASN . 27.8 mm -61.87 -45.78 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.883 0.473 . . . . 75.15 110.142 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -106.33 -84.16 0.51 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.612 -0.709 . . . . 74.54 111.265 -174.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.401 ' H ' HD11 ' A' ' 23' ' ' LEU . 65.0 t30 46.58 87.02 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.238 1.415 . . . . 74.43 112.894 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -93.17 -83.98 0.3 Allowed 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.027 -0.421 . . . . 74.43 110.575 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -120.13 83.81 0.36 Allowed Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 109.987 -1.245 . . . . 73.43 109.987 177.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.07 -134.94 20.67 Favored Glycine 0 N--CA 1.449 -0.46 0 O-C-N 124.395 0.703 . . . . 44.31 111.422 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.404 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 3.0 pptp? -97.91 -22.03 16.56 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 123.8 0.353 . . . . 74.3 111.157 178.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.454 ' HB2' ' OE1' ' A' ' 54' ' ' GLU . 53.3 ttp180 -70.23 -51.04 33.77 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.568 0.543 . . . . 74.12 110.33 -178.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.33 -29.18 71.95 Favored Glycine 0 C--O 1.223 -0.571 0 O-C-N 124.183 0.927 . . . . 55.44 112.592 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.706 HD23 HD22 ' A' ' 12' ' ' LEU . 26.8 tp -63.14 -41.86 99.38 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.264 0.625 . . . . 72.42 110.97 172.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.763 ' HG2' HD23 ' A' ' 46' ' ' LEU . 58.0 mtt -67.42 -37.91 83.77 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 122.979 0.512 . . . . 74.13 111.64 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 49.0 mm-40 -67.09 -37.8 84.58 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 123.411 0.445 . . . . 74.42 110.978 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -71.27 -33.89 70.19 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 112.388 0.514 . . . . 74.1 112.388 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.9 mt -71.56 -46.56 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 123.183 0.302 . . . . 64.13 111.049 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -71.95 -31.23 66.11 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.053 0.761 . . . . 65.25 113.053 -176.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.87 -30.37 50.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.541 0.2 . . . . 74.34 111.541 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.747 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.68 18.42 19.35 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.448 0.536 . . . . 71.33 112.448 -178.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 71.9 mt -57.81 -46.34 99.74 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 113.521 0.934 . . . . 74.45 113.521 171.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -67.96 -18.26 46.47 Favored 'Trans proline' 0 C--N 1.383 2.353 0 CA-C-N 121.666 1.631 . . . . 73.4 113.399 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.747 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 90.7 m-85 -90.44 -32.78 16.25 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 122.376 0.27 . . . . 75.22 111.574 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptp -81.6 168.9 17.69 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.608 0.242 . . . . 73.34 110.761 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.55 171.81 14.57 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.961 -0.563 . . . . 73.34 112.029 -177.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -36.85 85.44 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.57 -0.741 . . . . 64.52 112.936 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.22 -35.84 66.37 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.394 0.434 . . . . 73.14 110.753 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 50.6 ttm -73.99 -30.48 62.5 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.45 0.469 . . . . 74.33 111.065 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.4 mtm-85 -68.8 -41.56 78.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.766 0.284 . . . . 74.23 111.766 174.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.09 -47.68 85.2 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 123.838 0.711 . . . . 73.21 111.065 175.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.5 tp -61.49 -41.93 98.02 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 124.568 1.168 . . . . 74.42 111.58 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.601 ' HA ' HD23 ' A' ' 11' ' ' LEU . . . -55.73 -43.91 77.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.514 1.134 . . . . 74.41 113.468 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -64.12 -36.16 83.13 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.888 0.742 . . . . 75.42 112.441 -176.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -80.12 -34.86 37.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.406 -0.361 . . . . 75.51 111.964 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.436 HG21 HD22 ' A' ' 4' ' ' LEU . 13.7 m -72.28 -39.93 67.98 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.645 0.378 . . . . 65.43 111.618 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.763 HD23 ' HG2' ' A' ' 24' ' ' MET . 63.9 mt -65.93 -29.0 69.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.194 0.442 . . . . 74.42 112.194 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.13 -23.02 63.92 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 123.508 0.505 . . . . 53.01 112.189 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -87.49 -27.82 22.42 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 122.43 0.292 . . . . 73.35 111.665 -178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.546 HG22 HD13 ' A' ' 52' ' ' LEU . 9.9 mt -98.11 -12.39 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 121.144 0.497 . . . . 73.12 110.691 -176.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.01 99.31 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 114.456 1.28 . . . . 63.12 114.456 173.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.99 -12.56 26.04 Favored 'Trans proline' 0 C--N 1.385 2.486 0 CA-C-N 121.863 1.701 . . . . 74.34 114.414 174.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.586 HD11 HD13 ' A' ' 2' ' ' ILE . 72.6 mt -83.46 139.32 33.01 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.625 -0.509 . . . . 75.5 109.625 -176.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.4 t -82.8 168.41 17.18 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 120.857 -0.337 . . . . 75.23 110.252 179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.454 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 4.9 tp10 -64.13 -40.34 95.96 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.931 0.892 . . . . 74.41 111.404 -174.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -74.59 -29.73 61.43 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.862 -0.608 . . . . 70.43 111.597 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -72.11 -36.25 69.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.224 -0.443 . . . . 73.13 111.324 178.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -74.33 -23.16 59.01 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.318 -0.401 . . . . 72.34 110.744 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.71 -24.71 67.05 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.964 0.357 . . . . 72.25 111.964 174.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -76.17 -25.86 55.64 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.93 0.492 . . . . 75.32 111.588 175.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.538 HD23 ' HG3' ' A' ' 1' ' ' MET . 29.6 mt -93.29 -53.56 4.05 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.258 -0.428 . . . . 74.43 110.42 -175.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 63.92 -85.03 0.02 OUTLIER 'General case' 0 C--N 1.351 0.645 0 C-N-CA 126.477 1.911 . . . . 73.3 112.603 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.603 HD11 ' HA ' ' A' ' 13' ' ' SER . 49.5 mm -120.12 -44.79 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 108.838 -0.801 . . . . 74.41 108.838 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 72.12 -79.83 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.117 1.767 . . . . 74.51 112.669 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.08 69.22 1.48 Allowed 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 121.202 0.525 . . . . 73.11 112.147 -172.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -119.11 -5.34 10.5 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.304 0.574 . . . . 62.4 111.237 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -84.37 1.14 46.53 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.746 -0.661 . . . . 74.31 111.036 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -88.89 -29.25 19.76 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.114 -0.494 . . . . 72.4 111.846 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.485 HG13 HG22 ' A' ' 6' ' ' ILE . 5.7 m -87.07 -31.68 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-O 119.304 -0.379 . . . . 75.21 111.276 175.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.5 mt 64.71 -83.73 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.045 1.338 . . . . 74.21 112.071 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -109.02 136.46 48.51 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-O 121.109 0.48 . . . . 70.4 110.242 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -134.66 -20.33 1.79 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.363 -0.835 . . . . 71.32 110.829 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -135.4 17.22 3.39 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 120.748 -0.381 . . . . 75.23 111.946 -172.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.7 t60 74.83 -54.5 0.66 Allowed 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 125.698 1.599 . . . . 75.52 113.145 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 22.4 m80 68.13 168.98 0.27 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 125.457 1.503 . . . . 75.43 112.933 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -134.23 99.48 4.41 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.332 -0.988 . . . . 74.14 108.332 175.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 . . . . . 0 N--CA 1.479 1.015 0 O-C-N 124.863 1.352 . . . . 75.24 110.76 -175.571 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 ptm . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.801 0.334 . . . . 73.0 110.679 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.0 tt -89.45 149.45 4.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.898 -0.778 . . . . 74.42 108.898 176.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -100.53 102.14 13.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.68 0.753 . . . . 73.51 109.553 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.3 mt -78.97 149.67 32.21 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 114.3 -1.318 . . . . 75.04 109.22 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 14.8 t -72.82 156.09 39.26 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.905 -0.776 . . . . 72.11 108.905 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.591 HD12 ' HB2' ' A' ' 67' ' ' GLU . 48.0 mt -62.39 -27.26 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 123.853 0.861 . . . . 64.54 111.505 -173.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -73.12 -35.07 66.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.909 0.483 . . . . 63.05 111.877 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -73.18 -35.42 66.39 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.262 0.225 . . . . 50.03 110.977 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.588 HG21 ' H ' ' A' ' 64' ' ' ALA . 5.7 m -73.5 -28.95 62.18 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.852 0.72 . . . . 72.03 110.596 178.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.728 ' HB2' HG23 ' A' ' 68' ' ' VAL . 55.0 t30 -66.15 -39.69 90.0 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.904 -0.589 . . . . 71.41 110.879 170.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.445 HD11 ' HG3' ' A' ' 38' ' ' MET . 62.8 tp -67.05 -34.3 77.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.838 0.455 . . . . 70.24 111.064 177.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.628 HD13 ' HE1' ' A' ' 57' ' ' TYR . 72.4 mt -67.97 -32.86 73.57 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.585 -0.734 . . . . 73.42 111.088 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -72.01 -37.28 69.82 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.485 0.714 . . . . 74.51 112.484 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 10' ' ' ASN . 90.3 mt -69.07 -45.48 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-O 120.968 0.414 . . . . 63.4 110.808 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -102.02 28.08 6.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.125 -0.489 . . . . 72.44 111.545 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.42 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 12.9 t-20 -73.27 100.3 3.1 Favored 'General case' 0 C--N 1.344 0.339 0 O-C-N 123.606 0.567 . . . . 75.22 110.247 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -113.84 -69.25 0.87 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.344 -0.844 . . . . 71.33 111.479 -174.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -146.56 64.0 0.44 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.893 -0.67 . . . . 45.44 111.869 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.19 -157.41 40.85 Favored Glycine 0 C--O 1.225 -0.42 0 C-N-CA 121.443 -0.408 . . . . 51.32 112.1 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -69.53 -33.9 73.47 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 122.595 0.358 . . . . 75.4 111.495 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.519 ' HA ' ' HD3' ' A' ' 21' ' ' ARG . 12.3 mmt180 -73.45 -43.46 60.25 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-O 118.803 -0.618 . . . . 72.3 112.133 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.82 -27.72 71.58 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 120.982 -0.628 . . . . 54.13 112.905 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.3 mm? -67.56 -54.49 19.47 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 122.843 0.457 . . . . 72.42 111.27 170.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.745 ' HG2' HD22 ' A' ' 46' ' ' LEU . 30.8 mtt -64.45 -44.46 91.02 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.014 0.746 . . . . 75.15 113.014 -174.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 18.1 mm-40 -68.9 -36.6 78.22 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 122.71 0.404 . . . . 71.23 111.795 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -70.91 -46.28 62.8 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.955 -0.387 . . . . 75.43 109.955 177.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.55 HG23 ' HE3' ' A' ' 34' ' ' MET . 34.5 mt -62.29 -41.96 93.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.32 0.648 . . . . 74.55 112.338 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.14 -42.82 95.69 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.308 0.643 . . . . 74.21 112.183 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -27.34 36.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 74.43 112.073 -177.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.746 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -97.48 11.39 36.95 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 113.173 0.805 . . . . 74.31 113.173 -174.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 55.4 mt -57.9 -45.88 99.76 Favored Pre-proline 0 CA--C 1.557 1.215 0 N-CA-C 114.458 1.281 . . . . 73.0 114.458 177.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.3 -12.21 31.47 Favored 'Trans proline' 0 C--N 1.384 2.401 0 C-N-CA 121.815 1.677 . . . . 75.31 113.999 173.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.746 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 74.3 m-85 -96.77 -7.84 32.75 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.36 0.264 . . . . 75.51 111.24 -178.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.55 ' HE3' HG23 ' A' ' 27' ' ' ILE . 64.3 mtt -83.05 154.91 24.18 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.317 0.58 . . . . 74.33 111.846 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.74 158.93 35.23 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 114.386 -1.279 . . . . 64.21 109.048 171.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -47.69 -38.94 16.16 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.753 1.221 . . . . 74.32 113.819 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.18 -51.69 42.87 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 123.352 0.407 . . . . 75.13 111.697 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' MET . . . . . 0.445 ' HG3' HD11 ' A' ' 11' ' ' LEU . 0.5 OUTLIER -73.74 -28.23 61.58 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.867 0.691 . . . . 74.0 112.867 -173.672 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -68.03 -55.72 11.55 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 123.686 0.794 . . . . 75.33 111.566 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -70.73 -29.23 65.44 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.855 0.687 . . . . 71.32 112.855 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.2 tp -63.8 -38.91 92.86 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 123.734 0.646 . . . . 75.42 110.7 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.467 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -60.86 -37.05 80.76 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 113.711 1.004 . . . . 75.21 113.711 -175.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.62 -37.12 86.47 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.39 0.431 . . . . 64.23 110.743 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -80.07 -31.75 39.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.666 -0.697 . . . . 75.25 111.327 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.1 m -69.66 -43.11 73.24 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 122.856 0.463 . . . . 53.21 110.355 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.745 HD22 ' HG2' ' A' ' 24' ' ' MET . 85.9 mt -68.75 -29.39 67.78 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.654 -0.703 . . . . 73.22 111.731 178.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.79 -24.15 61.69 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 123.438 0.461 . . . . 75.41 111.474 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -87.52 -33.03 19.1 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.347 0.499 . . . . 72.41 112.347 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.48 HG13 ' HE2' ' A' ' 24' ' ' MET . 34.8 pt -90.92 -13.93 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 112.894 0.702 . . . . 71.15 112.894 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -49.78 91.9 Favored Pre-proline 0 N--CA 1.48 1.067 0 CA-C-O 117.797 -1.097 . . . . 64.55 113.619 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -73.87 -10.73 23.37 Favored 'Trans proline' 0 C--N 1.384 2.435 0 C-N-CA 121.708 1.605 . . . . 75.44 113.213 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.521 HD23 ' HG2' ' A' ' 56' ' ' GLU . 78.0 mt -81.55 148.5 29.11 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.667 -0.494 . . . . 74.31 109.667 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.489 HG21 ' H ' ' A' ' 56' ' ' GLU . 7.1 t -77.95 167.52 21.35 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.399 -0.593 . . . . 65.2 109.399 170.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -66.79 -31.76 72.6 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.886 0.474 . . . . 74.41 110.415 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -73.31 -29.71 62.88 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.36 -0.837 . . . . 75.22 111.008 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.521 ' HG2' HD23 ' A' ' 52' ' ' LEU . 4.9 tp10 -66.73 -46.42 75.53 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.861 0.464 . . . . 75.44 109.793 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.628 ' HE1' HD13 ' A' ' 12' ' ' LEU . 76.0 t80 -67.36 -29.09 68.54 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 123.774 0.671 . . . . 62.45 111.552 177.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.64 -33.45 72.8 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.422 0.527 . . . . 75.41 112.422 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -80.51 -29.5 37.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.319 -0.4 . . . . 75.42 111.514 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.0 mt -104.01 16.7 25.7 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.705 0.631 . . . . 73.42 112.705 -171.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.75 -69.97 0.1 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 73.55 113.294 -169.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mp -121.68 89.55 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 107.227 -1.398 . . . . 71.4 107.227 169.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -90.02 -64.98 1.06 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.997 -1.456 . . . . 72.14 109.945 -178.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.588 ' H ' HG21 ' A' ' 9' ' ' THR . . . -121.35 96.34 5.05 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.37 -0.377 . . . . 75.32 110.853 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -131.69 6.18 4.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.904 0.383 . . . . 73.0 110.546 175.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.93 -35.77 62.16 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.686 -0.688 . . . . 61.01 111.5 -176.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.591 ' HB2' HD12 ' A' ' 6' ' ' ILE . 40.3 mt-10 -92.42 11.54 25.8 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.248 -0.887 . . . . 74.21 112.356 -170.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.728 HG23 ' HB2' ' A' ' 10' ' ' ASN . 3.3 m -119.24 2.88 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.322 -0.399 . . . . 75.42 110.823 169.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.4 mt -77.79 154.1 32.23 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.539 -0.541 . . . . 74.04 109.539 174.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 71.57 9.74 6.4 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 124.898 1.374 . . . . 71.24 111.401 -174.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -85.83 73.95 10.27 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-O 122.411 1.1 . . . . 70.04 108.951 175.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -146.92 -30.63 0.35 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 113.575 -1.648 . . . . 75.33 107.825 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -75.06 135.16 41.23 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 109.1 -0.704 . . . . 73.31 109.1 175.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 54.97 69.0 0.78 Allowed 'General case' 0 N--CA 1.476 0.843 0 O-C-N 124.681 1.238 . . . . 73.33 112.118 -177.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -87.32 103.87 15.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.415 -0.811 . . . . 74.52 109.594 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.286 -0.87 . . . . 73.41 109.998 -178.706 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.535 ' HG3' HD11 ' A' ' 60' ' ' LEU . 50.0 ttm . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 109.893 -0.41 . . . . 75.35 109.893 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.53 HG21 HD23 ' A' ' 52' ' ' LEU . 19.5 pt -91.88 163.1 2.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.055 0.455 . . . . 74.43 111.687 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.39 115.66 30.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.038 -1.097 . . . . 74.42 108.038 174.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt -110.69 155.72 22.03 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.736 -0.665 . . . . 73.43 110.694 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.1 t -88.56 170.69 10.65 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.014 -0.736 . . . . 70.23 109.014 173.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -66.79 -30.97 51.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.039 0.535 . . . . 74.14 111.185 -172.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.74 -49.82 73.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.252 0.621 . . . . 65.23 111.708 177.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -66.06 -39.27 89.95 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.429 0.691 . . . . 75.11 111.864 -175.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.401 ' HA ' HD11 ' A' ' 12' ' ' LEU . 3.8 p -74.63 -26.34 59.82 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.855 0.687 . . . . 71.12 112.855 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -67.76 -32.48 73.11 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.052 0.541 . . . . 72.23 110.919 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.484 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 16.6 tp -64.55 -39.58 94.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.409 0.684 . . . . 73.11 111.048 172.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.401 HD11 ' HA ' ' A' ' 9' ' ' THR . 55.4 mt -69.53 -32.14 70.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.381 -0.827 . . . . 74.4 111.037 178.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.556 ' HA ' HD11 ' A' ' 62' ' ' ILE . 22.6 t -69.37 -24.85 63.93 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 73.12 111.867 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.8 mt -67.19 -44.27 87.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 122.691 0.396 . . . . 74.35 110.341 174.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.439 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 95.5 m-85 -95.98 -86.84 0.3 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.313 0.486 . . . . 75.3 112.313 -175.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.533 ' HA ' HD23 ' A' ' 23' ' ' LEU . 13.4 t-20 53.87 85.32 0.05 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.905 1.282 . . . . 75.31 112.041 -171.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -88.82 -81.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.182 -0.463 . . . . 74.41 111.104 -177.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -163.52 53.6 0.29 Allowed Glycine 0 CA--C 1.499 -0.937 0 N-CA-C 110.5 -1.04 . . . . 73.1 110.5 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.83 -175.28 16.24 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.729 -0.948 . . . . 65.52 110.729 -175.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.449 ' HD3' HG23 ' A' ' 49' ' ' ILE . 3.0 pptp? -83.92 -18.54 37.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.696 0.248 . . . . 72.1 111.565 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.522 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 22.5 ttm180 -65.25 -52.18 56.09 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 123.824 0.702 . . . . 74.01 109.319 172.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.76 -29.6 75.46 Favored Glycine 0 N--CA 1.449 -0.467 0 O-C-N 124.516 1.135 . . . . 54.54 113.378 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.533 HD23 ' HA ' ' A' ' 16' ' ' ASN . 1.3 mm? -64.07 -42.31 97.02 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 116.901 0.351 . . . . 72.42 110.925 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.631 ' HG2' HD23 ' A' ' 46' ' ' LEU . 64.0 mtt -69.07 -41.19 77.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.848 0.314 . . . . 74.23 111.848 178.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 7.5 mm-40 -65.01 -36.24 83.76 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.61 0.243 . . . . 74.3 111.48 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.439 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.9 m-80 -78.85 -44.1 23.66 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 112.56 0.578 . . . . 72.35 112.56 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.407 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 52.6 mt -64.55 -51.34 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 119.17 -0.443 . . . . 73.22 111.837 -178.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -62.41 -37.52 86.11 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.145 0.794 . . . . 62.41 113.145 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.69 -30.13 27.02 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.491 0.552 . . . . 72.43 112.491 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.515 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -104.47 19.54 20.12 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.229 0.455 . . . . 71.44 112.229 -175.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 89.5 mt -55.05 -45.36 99.85 Favored Pre-proline 0 CA--C 1.559 1.292 0 N-CA-C 113.629 0.974 . . . . 74.15 113.629 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -67.89 -13.55 38.79 Favored 'Trans proline' 0 C--N 1.394 2.952 0 C-N-CA 122.063 1.842 . . . . 74.35 114.094 174.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.515 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.9 m-85 -92.03 -10.44 39.19 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.517 0.198 . . . . 75.34 111.158 178.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.0 mtm -99.95 -177.97 3.71 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.34 0.59 . . . . 71.33 111.902 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.37 159.86 28.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.03 -0.987 . . . . 74.43 110.23 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.57 -36.59 83.02 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.203 0.601 . . . . 52.4 111.596 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.45 -35.93 73.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.078 0.466 . . . . 65.21 110.254 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -25.98 61.33 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.456 -0.793 . . . . 72.14 111.839 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 -68.82 -41.83 78.07 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.117 0.567 . . . . 71.11 110.838 177.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -73.04 -31.74 64.63 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.324 -0.398 . . . . 74.24 111.652 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 42.9 tp -68.17 -34.66 76.71 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.046 -0.525 . . . . 74.54 111.062 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.484 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -59.0 -41.37 87.49 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 123.625 0.77 . . . . 61.15 112.566 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -66.47 -35.26 79.83 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 123.828 0.705 . . . . 74.43 111.493 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -69.88 -42.82 72.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.963 -0.562 . . . . 73.24 111.447 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.0 m -72.53 -36.75 68.38 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.684 0.615 . . . . 73.22 111.195 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.631 HD23 ' HG2' ' A' ' 24' ' ' MET . 82.5 mt -67.37 -28.32 67.85 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.196 0.443 . . . . 72.42 112.196 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.9 61.35 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.762 0.315 . . . . 73.03 111.534 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -83.7 -32.91 25.3 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.963 0.505 . . . . 74.42 111.315 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.695 HG22 HD11 ' A' ' 52' ' ' LEU . 7.3 mt -94.54 -10.86 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 121.245 0.545 . . . . 73.14 110.797 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.65 -45.77 99.91 Favored Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 114.509 1.3 . . . . 61.4 114.509 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -77.63 -1.88 12.04 Favored 'Trans proline' 0 C--N 1.388 2.61 0 CA-C-N 121.854 1.698 . . . . 73.33 113.605 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.695 HD11 HG22 ' A' ' 49' ' ' ILE . 57.7 mt -86.56 140.79 29.55 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.061 -0.718 . . . . 71.32 109.061 174.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 t -84.22 170.37 13.81 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 108.521 -0.918 . . . . 74.01 108.521 168.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.453 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 15.0 tp10 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.687 0.795 . . . . 64.13 112.88 -166.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -75.29 -28.2 59.64 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.216 -0.902 . . . . 75.54 112.497 -173.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.65 -52.18 66.63 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.573 0.546 . . . . 71.34 112.273 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -69.12 -24.75 64.15 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.624 0.578 . . . . 72.41 111.841 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.4 -29.45 70.51 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 111.798 0.296 . . . . 73.32 111.798 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -81.99 -15.03 55.1 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.589 0.589 . . . . 74.54 112.589 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.535 HD11 ' HG3' ' A' ' 1' ' ' MET . 4.6 mp -84.35 -52.21 6.37 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.363 -0.21 . . . . 73.42 110.675 175.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 57.66 -101.05 0.12 Allowed 'General case' 0 C--N 1.354 0.796 0 O-C-N 125.168 1.542 . . . . 62.24 111.457 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.556 HD11 ' HA ' ' A' ' 13' ' ' SER . 40.1 mm -113.89 90.94 1.61 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 107.635 -1.246 . . . . 74.25 107.635 169.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -96.28 105.27 17.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.916 -0.772 . . . . 74.42 108.916 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 70.66 -166.13 0.15 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 125.4 1.48 . . . . 72.34 109.995 -166.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 78.28 -22.45 0.28 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 126.121 1.768 . . . . 63.12 114.866 173.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -74.52 -16.42 60.83 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 117.999 0.363 . . . . 75.42 111.593 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -74.64 -11.7 60.25 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 123.368 0.667 . . . . 74.54 112.155 -176.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.8 m -78.11 -24.47 13.93 Favored 'Isoleucine or valine' 0 C--N 1.348 0.519 0 CA-C-N 117.989 0.359 . . . . 63.34 110.8 175.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 44.9 mt -73.87 -19.42 60.72 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.24 0.543 . . . . 72.22 110.523 179.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -94.87 -34.15 12.55 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.348 -0.842 . . . . 75.42 110.003 174.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -71.79 -49.04 42.3 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.073 -0.512 . . . . 74.12 111.903 -172.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -102.52 -23.42 13.9 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 120.664 -0.414 . . . . 53.51 111.697 178.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m80 60.58 -90.8 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.674 1.19 . . . . 75.1 110.844 -170.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -141.68 154.35 45.27 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.333 -1.358 . . . . 71.43 107.333 169.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -87.24 87.78 7.52 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.419 0.628 . . . . 74.34 109.76 174.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 . . . . . 0 C--O 1.234 0.28 0 CA-C-N 114.537 -1.211 . . . . 71.55 108.803 179.123 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ttt . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 109.883 -0.414 . . . . 73.42 109.883 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.532 HG21 HD11 ' A' ' 52' ' ' LEU . 18.4 tt -90.66 145.92 6.83 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 CA-C-O 121.149 0.5 . . . . 75.23 109.842 174.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -99.21 105.94 18.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.787 -0.642 . . . . 75.51 110.131 177.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 70.9 mt -108.65 150.59 27.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.53 -0.759 . . . . 75.21 110.256 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.9 t -84.3 170.24 13.87 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.602 -0.518 . . . . 75.41 109.602 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.63 -33.71 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.656 0.782 . . . . 71.41 111.014 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.41 -34.82 65.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.259 0.466 . . . . 73.34 112.259 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 53.8 mt-10 -70.15 -39.59 75.28 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.419 0.155 . . . . 64.43 111.419 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.433 HG23 ' H ' ' A' ' 64' ' ' ALA . 2.5 m -73.91 -28.03 61.33 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 123.562 0.539 . . . . 72.24 110.815 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -65.62 -41.61 92.51 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.949 0.5 . . . . 74.33 110.334 174.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.472 HD22 ' HA ' ' A' ' 42' ' ' ALA . 51.4 tp -68.15 -34.6 76.64 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.244 -0.889 . . . . 75.31 111.256 177.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 91.5 mt -65.1 -36.02 82.96 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 115.656 -0.702 . . . . 70.11 111.656 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.1 m -65.62 -28.28 69.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 123.811 0.694 . . . . 75.31 112.148 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 55.4 mt -71.39 -37.78 66.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.003 0.521 . . . . 73.22 110.945 -177.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -119.11 27.33 8.91 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.742 0.275 . . . . 73.5 111.742 -174.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.529 ' HA ' HD21 ' A' ' 23' ' ' LEU . 9.7 t30 -76.94 101.21 5.87 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.058 -0.519 . . . . 71.22 111.736 -172.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -118.66 -117.88 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.488 -0.778 . . . . 75.11 112.249 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -96.64 87.83 0.96 Allowed Glycine 0 C--N 1.341 0.84 0 C-N-CA 121.325 -0.464 . . . . 63.21 112.985 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.28 -150.91 46.16 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 111.645 -0.582 . . . . 61.31 111.645 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.619 ' HG2' ' HB3' ' A' ' 54' ' ' GLU . 4.7 pttp -85.38 -17.39 36.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.751 -0.38 . . . . 72.24 110.431 175.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -67.45 -48.84 66.07 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.894 -0.593 . . . . 73.13 109.942 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.35 -33.08 86.29 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 123.89 0.744 . . . . 72.35 113.342 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.529 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.9 mm? -64.8 -51.78 60.38 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.9 0.35 . . . . 73.51 111.894 176.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.5 mtp -70.77 -34.6 71.98 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.457 0.473 . . . . 74.23 111.648 -173.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -66.45 -43.85 84.42 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 111.974 0.361 . . . . 74.13 111.974 175.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -69.4 -40.87 77.08 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 112.523 0.564 . . . . 75.32 112.523 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.473 ' CG2' ' HB1' ' A' ' 42' ' ' ALA . 63.8 mt -65.89 -44.75 92.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 119.149 -0.453 . . . . 61.24 111.426 -177.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.437 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 49.2 m-80 -70.12 -25.78 63.65 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.562 0.579 . . . . 70.44 112.562 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.86 -27.97 33.23 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 111.655 0.243 . . . . 74.1 111.655 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -98.28 7.65 45.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.934 0.346 . . . . 73.44 111.934 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 89.2 mt -58.55 -45.38 99.67 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-O 118.3 -0.857 . . . . 71.13 112.955 173.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -64.0 -5.77 9.89 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 122.567 2.178 . . . . 54.02 114.598 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -108.23 -134.56 0.34 Allowed 'General case' 0 C--O 1.242 0.665 0 N-CA-C 108.172 -1.047 . . . . 64.11 108.172 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtt 61.11 -105.44 0.2 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.784 1.234 . . . . 74.41 110.875 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -159.19 -69.08 0.08 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.933 0.893 . . . . 74.53 109.355 172.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 176.01 -40.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.478 1.511 . . . . 73.42 108.507 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.22 -50.39 63.96 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.864 -1.062 . . . . 74.2 110.222 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 42.9 mtp -64.37 -27.9 69.33 Favored 'General case' 0 C--O 1.209 -1.066 0 O-C-N 123.839 0.712 . . . . 73.52 112.212 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -73.73 -49.76 24.04 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.448 0.468 . . . . 73.11 111.705 -176.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -72.47 -32.0 65.88 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.85 0.315 . . . . 73.42 111.85 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.4 tp -69.12 -33.62 73.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.087 -0.506 . . . . 51.12 110.7 174.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.473 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -66.37 -31.67 72.58 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-N 116.006 -0.543 . . . . 63.2 112.084 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -70.38 -31.49 68.75 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.623 0.577 . . . . 75.02 111.381 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -71.05 -38.69 72.53 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.284 0.365 . . . . 75.41 111.55 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.49 ' O ' HG13 ' A' ' 49' ' ' ILE . 13.8 m -73.56 -33.92 64.92 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 123.537 0.523 . . . . 70.45 111.227 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 90.1 mt -67.09 -31.92 72.73 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.547 0.339 . . . . 71.32 111.638 174.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.52 -20.34 62.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 123.582 0.551 . . . . 71.35 111.635 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.22 -40.66 23.48 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.621 -0.263 . . . . 74.22 111.091 176.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 45' ' ' THR . 2.0 mt -89.73 -15.86 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 112.215 0.45 . . . . 73.42 112.215 -172.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -47.51 98.57 Favored Pre-proline 0 CA--C 1.555 1.17 0 N-CA-C 114.13 1.159 . . . . 71.14 114.13 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.21 0.97 9.32 Favored 'Trans proline' 0 C--N 1.378 2.107 0 CA-C-N 121.855 1.698 . . . . 72.04 113.789 174.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.532 HD11 HG21 ' A' ' 2' ' ' ILE . 88.0 mt -87.23 158.08 19.18 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.033 0.444 . . . . 64.31 110.367 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.572 HG23 ' H ' ' A' ' 56' ' ' GLU . 7.5 t -102.02 158.49 16.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.748 -0.834 . . . . 74.14 108.748 169.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.619 ' HB3' ' HG2' ' A' ' 20' ' ' LYS . 4.8 pt-20 -87.2 -4.4 59.1 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.719 0.295 . . . . 74.32 111.064 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.04 -45.44 70.44 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.563 -0.744 . . . . 72.13 109.516 166.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.572 ' H ' HG23 ' A' ' 53' ' ' THR . 29.8 tt0 -76.93 -34.35 57.67 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.889 -0.596 . . . . 74.15 110.854 177.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -67.4 -25.08 65.77 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 123.271 0.357 . . . . 74.15 110.998 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.05 -37.99 81.97 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.094 -0.379 . . . . 71.42 111.246 174.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -79.87 -19.94 47.08 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.386 0.513 . . . . 73.44 112.386 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 83.3 mt -84.06 -68.23 0.73 Allowed 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.854 -0.424 . . . . 74.32 109.854 173.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.82 -127.7 2.36 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 125.525 1.53 . . . . 64.23 111.452 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 39.4 mm -99.34 95.34 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 107.974 -1.121 . . . . 75.12 107.974 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -106.34 -7.44 17.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.278 -0.874 . . . . 75.3 111.303 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.433 ' H ' HG23 ' A' ' 9' ' ' THR . . . -137.12 -172.84 3.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.677 -0.861 . . . . 72.45 108.677 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 67.45 18.93 10.09 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.854 1.262 . . . . 72.23 111.802 -175.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -92.14 -14.77 28.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.673 -0.694 . . . . 71.4 110.591 177.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -90.52 -14.63 32.26 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.695 -0.684 . . . . 71.3 111.521 -178.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.6 m -89.49 -5.35 10.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 116.588 -0.278 . . . . 62.53 111.411 -175.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.98 117.02 10.12 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.865 -0.607 . . . . 73.43 110.771 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 75.26 -11.38 1.1 Allowed 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 125.663 1.585 . . . . 75.31 113.765 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -73.55 -36.39 65.64 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.335 0.516 . . . . 74.44 109.906 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -121.51 123.93 43.2 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.722 -0.844 . . . . 74.43 108.722 167.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -95.26 118.24 31.69 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.055 -0.521 . . . . 75.55 110.404 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -138.79 128.44 24.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.851 -0.613 . . . . 74.55 109.583 -178.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -75.12 146.63 41.22 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.912 -0.585 . . . . 55.42 111.323 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.7 m80 . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.398 -0.819 . . . . 75.1 111.159 -176.183 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.3 tpp . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.953 0.406 . . . . 74.45 110.83 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.696 HG12 HD12 ' A' ' 52' ' ' LEU . 18.6 pt -129.42 -178.15 2.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 115.829 -0.623 . . . . 72.44 109.471 173.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -117.22 114.41 23.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.604 0.716 . . . . 74.42 111.574 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.466 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 5.1 mp -95.0 152.06 18.64 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.723 -1.214 . . . . 72.12 107.723 167.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.692 HG22 ' HG3' ' A' ' 8' ' ' GLU . 4.2 t -76.14 171.54 14.33 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 109.472 -0.566 . . . . 75.13 109.472 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.837 HG22 HG11 ' A' ' 68' ' ' VAL . 9.1 mm -61.78 -36.67 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.142 0.577 . . . . 74.44 111.859 -170.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.02 -24.9 59.62 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.172 0.805 . . . . 72.42 113.172 176.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.692 ' HG3' HG22 ' A' ' 5' ' ' THR . 46.7 mt-10 -75.42 -38.78 59.62 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 117.762 0.256 . . . . 75.55 111.053 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.12 -28.68 62.4 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.464 0.478 . . . . 74.3 111.871 174.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.816 ' HB2' HG13 ' A' ' 68' ' ' VAL . 14.5 t-20 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.472 0.482 . . . . 73.45 110.652 170.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.452 ' HA ' HD11 ' A' ' 14' ' ' ILE . 49.2 tp -64.74 -33.6 76.35 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 124.028 0.83 . . . . 74.4 111.646 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.58 ' HA ' HD12 ' A' ' 23' ' ' LEU . 81.1 mt -59.59 -47.74 84.38 Favored 'General case' 0 C--O 1.214 -0.812 0 O-C-N 124.032 0.833 . . . . 64.3 111.731 175.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 46.2 p -71.55 -23.2 61.72 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.711 0.634 . . . . 73.22 112.711 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.452 HD11 ' HA ' ' A' ' 11' ' ' LEU . 87.9 mt -64.73 -51.52 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 122.766 0.426 . . . . 72.5 111.278 175.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.524 ' HB2' HD13 ' A' ' 23' ' ' LEU . 68.9 m-85 -106.3 29.8 6.51 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.057 0.392 . . . . 75.42 112.057 -174.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 14.7 t-20 -84.09 102.45 12.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.247 -0.433 . . . . 63.54 111.415 -176.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -123.22 -26.7 4.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.855 -0.611 . . . . 73.41 111.74 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.12 69.5 0.17 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.698 -0.763 . . . . 64.52 112.055 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.83 -149.28 46.12 Favored Glycine 0 N--CA 1.45 -0.372 0 O-C-N 123.859 0.388 . . . . 64.15 112.439 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.842 ' HE3' ' HA ' ' A' ' 53' ' ' THR . 0.6 OUTLIER -90.4 -11.17 41.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.741 0.305 . . . . 75.23 110.436 178.824 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -65.5 -52.86 49.7 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 123.963 0.905 . . . . 75.3 109.283 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.8 -30.34 74.4 Favored Glycine 0 C--O 1.218 -0.888 0 CA-C-N 114.966 -1.015 . . . . 41.5 112.622 174.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.687 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -62.28 -46.95 86.47 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 117.15 0.475 . . . . 70.3 111.353 175.32 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.604 ' HG2' HD21 ' A' ' 46' ' ' LEU . 46.3 mtt -63.72 -43.77 95.56 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.242 0.617 . . . . 74.34 112.369 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.11 -36.0 64.19 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.584 0.553 . . . . 75.33 112.02 -176.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -74.54 -33.67 62.79 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 119.534 -0.27 . . . . 64.02 111.52 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.479 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 11.9 mt -66.6 -49.73 72.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-O 119.282 -0.39 . . . . 71.04 111.17 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -65.27 -35.59 81.5 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.436 0.532 . . . . 74.44 112.436 -177.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.62 -34.53 58.35 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 111.971 0.359 . . . . 64.14 111.971 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.729 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.11 17.34 21.39 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 112.676 0.621 . . . . 75.01 112.676 -176.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 70.3 mt -57.83 -44.44 99.41 Favored Pre-proline 0 CA--C 1.554 1.134 0 N-CA-C 113.673 0.99 . . . . 74.34 113.673 172.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -69.61 -15.97 37.93 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 121.931 1.754 . . . . 74.01 113.787 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.729 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 99.4 m-85 -92.03 -9.95 40.94 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.566 0.346 . . . . 72.22 111.616 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.527 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 65.7 mtt -85.28 162.77 18.98 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.294 0.569 . . . . 65.43 111.309 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.89 149.98 37.67 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 107.064 -1.458 . . . . 74.11 107.064 160.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.63 -25.13 66.07 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.081 0.771 . . . . 75.3 113.081 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -66.46 -48.53 69.63 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.69 0.618 . . . . 75.11 111.095 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 31.8 ttp -77.42 -24.29 50.44 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.501 -0.772 . . . . 75.51 111.155 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.449 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 57.4 ttt180 -63.52 -53.03 58.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.78 1.232 . . . . 75.13 111.878 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.696 0.398 . . . . 74.23 112.059 174.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.4 tp -61.94 -39.0 90.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 122.524 0.33 . . . . 73.22 110.707 172.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.3 -30.18 70.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.187 0.995 . . . . 72.5 112.329 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 43' ' ' LYS . 14.2 tppt? -65.46 -39.47 92.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.347 -0.842 . . . . 74.34 110.453 175.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 20.8 mmt180 -71.06 -38.56 72.49 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.654 -0.703 . . . . 73.32 111.85 176.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.466 ' O ' HG13 ' A' ' 49' ' ' ILE . 33.3 m -67.86 -40.4 83.63 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.665 0.603 . . . . 74.2 111.647 -177.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.604 HD21 ' HG2' ' A' ' 24' ' ' MET . 21.4 mt -70.06 -28.76 65.71 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.949 0.351 . . . . 73.44 111.949 178.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.09 -25.57 62.67 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 123.423 0.452 . . . . 72.22 111.427 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -73.72 -49.38 25.89 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 122.433 0.293 . . . . 74.14 111.327 176.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.501 HD11 HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -95.42 3.45 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 112.285 0.476 . . . . 75.2 112.285 -169.504 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.42 ' HB1' ' HD3' ' A' ' 51' ' ' PRO . . . -52.64 -48.69 89.68 Favored Pre-proline 0 CA--C 1.556 1.206 0 N-CA-C 114.019 1.118 . . . . 72.55 114.019 171.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.42 ' HD3' ' HB1' ' A' ' 50' ' ' ALA . 2.8 Cg_exo -80.59 -3.81 12.63 Favored 'Trans proline' 0 C--N 1.379 2.157 0 CA-C-N 121.917 1.72 . . . . 74.54 113.977 173.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.696 HD12 HG12 ' A' ' 2' ' ' ILE . 77.5 mt -104.86 81.72 1.79 Allowed 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.086 0.469 . . . . 75.35 110.195 -177.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.842 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 2.7 t -87.13 87.68 7.51 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.165 0.802 . . . . 74.41 113.165 -173.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.425 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 17.0 mm-40 79.72 -66.15 0.17 Allowed 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.976 1.31 . . . . 75.02 113.395 162.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -70.91 -31.19 67.73 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.475 0.71 . . . . 75.15 110.242 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 1.8 mm-40 -76.52 -28.35 56.33 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.564 -0.744 . . . . 74.54 110.505 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -72.03 -25.54 61.85 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.496 0.718 . . . . 72.15 110.765 174.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.26 -20.69 61.49 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 111.969 0.359 . . . . 74.11 111.969 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.16 -41.61 84.17 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.189 0.519 . . . . 75.55 110.766 168.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.526 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.0 mt -85.93 -61.46 1.75 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.823 -1.08 . . . . 74.12 110.607 -171.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.17 35.34 19.6 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 124.902 1.376 . . . . 73.32 112.772 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp 64.39 104.9 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.948 1.299 . . . . 71.43 110.767 -172.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.526 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 13.2 m-85 -93.21 -60.97 1.66 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.729 -0.669 . . . . 71.42 111.675 177.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -87.27 80.12 8.33 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.865 0.84 . . . . 72.31 112.122 -171.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -124.09 8.61 8.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.101 -0.954 . . . . 61.34 110.657 177.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -88.69 -33.53 17.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.59 -0.732 . . . . 71.32 110.296 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -89.04 -12.81 40.27 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.54 0.57 . . . . 74.41 112.54 -175.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.837 HG11 HG22 ' A' ' 6' ' ' ILE . 6.2 m -86.28 -1.01 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 113.066 0.765 . . . . 73.01 113.066 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -61.75 -37.12 83.08 Favored 'General case' 0 C--N 1.343 0.318 0 O-C-N 124.036 0.835 . . . . 74.14 111.475 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -129.07 21.04 5.81 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 121.634 0.731 . . . . 63.32 110.809 176.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -91.9 -20.14 21.73 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.378 -0.827 . . . . 75.5 110.194 176.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 -100.28 93.48 5.71 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.94 -0.763 . . . . 73.25 108.94 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -90.83 145.75 24.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.977 -1.011 . . . . 74.03 108.865 -177.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -67.46 132.03 46.84 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.367 0.603 . . . . 73.54 111.886 -174.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -110.34 -11.33 14.54 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.084 -0.71 . . . . 75.41 109.084 170.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 18.6 m80 . . . . . 0 C--O 1.237 0.416 0 CA-C-N 115.842 -0.617 . . . . 64.02 110.113 173.163 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.3 mtt . . . . . 0 N--CA 1.484 1.256 0 CA-C-O 120.652 0.263 . . . . 72.14 110.546 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.55 HG21 ' HG ' ' A' ' 4' ' ' LEU . 12.1 tt -132.54 146.32 33.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 N-CA-C 108.167 -1.049 . . . . 73.2 108.167 168.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -82.3 96.97 8.07 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.752 0.787 . . . . 73.02 110.446 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.55 ' HG ' HG21 ' A' ' 2' ' ' ILE . 77.6 mt -106.82 150.78 26.0 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.63 -1.168 . . . . 74.14 110.039 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.09 161.8 29.65 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.512 -0.551 . . . . 73.11 109.512 168.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.41 ' HA ' ' OG1' ' A' ' 9' ' ' THR . 13.5 mm -80.28 -9.26 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.275 0.56 . . . . 75.52 110.908 -175.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.09 -34.78 73.58 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.905 -0.497 . . . . 72.33 110.58 169.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.541 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.2 mm-40 -66.29 -49.14 68.09 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.756 0.66 . . . . 72.02 109.343 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.435 ' HB ' HG21 ' A' ' 62' ' ' ILE . 1.9 p -69.87 -26.89 64.41 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 123.943 0.777 . . . . 73.22 112.884 -177.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.31 -40.4 77.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.511 0.195 . . . . 71.24 111.056 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.1 tp -67.35 -38.94 85.62 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.225 0.61 . . . . 73.42 110.824 174.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 92.1 mt -65.71 -31.81 73.02 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.14 -0.937 . . . . 75.25 112.003 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -69.53 -32.26 70.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.369 0.668 . . . . 72.2 111.762 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 74.9 mt -68.77 -46.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 120.955 0.407 . . . . 74.22 110.283 178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -105.29 26.97 8.73 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.864 0.691 . . . . 74.41 112.864 -173.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.668 ' HA ' HD22 ' A' ' 23' ' ' LEU . 66.2 t30 -71.09 103.92 2.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.323 0.583 . . . . 72.33 111.263 -175.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -90.68 -22.7 21.02 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.646 -1.161 . . . . 74.0 109.892 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.03 -38.23 1.63 Allowed Glycine 0 C--N 1.336 0.555 0 C-N-CA 120.847 -0.692 . . . . 54.24 113.269 177.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.442 ' HA3' ' OE2' ' A' ' 54' ' ' GLU . . . -137.38 179.66 17.86 Favored Glycine 0 CA--C 1.504 -0.621 0 C-N-CA 121.174 -0.536 . . . . 62.15 111.967 -177.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.678 ' HD3' HG21 ' A' ' 49' ' ' ILE . 0.6 OUTLIER -77.59 -29.2 51.9 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 116.9 0.35 . . . . 75.33 110.904 -172.538 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -66.51 -47.84 71.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.835 0.71 . . . . 74.4 110.371 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.51 -32.88 82.97 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.637 -0.711 . . . . 64.35 113.265 176.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 16' ' ' ASN . 1.1 mm? -67.72 -40.65 84.23 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.35 0.5 . . . . 62.33 112.35 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 96.0 mtp -69.36 -28.91 66.61 Favored 'General case' 0 C--O 1.219 -0.544 0 O-C-N 123.053 0.22 . . . . 73.11 111.582 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -73.43 -43.46 60.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.191 0.196 . . . . 72.12 111.359 173.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.17 -42.53 99.42 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 74.24 111.867 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.747 HG21 ' HB2' ' A' ' 42' ' ' ALA . 83.1 mt -71.82 -42.85 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.053 -0.521 . . . . 75.41 111.518 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -62.62 -41.6 99.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.184 0.594 . . . . 74.5 111.96 -176.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.98 -34.6 50.83 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.91 -0.586 . . . . 74.21 112.049 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.519 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -97.18 18.03 15.88 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 113.242 0.83 . . . . 74.41 113.242 -171.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -54.02 -53.22 60.79 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 113.51 0.93 . . . . 75.31 113.51 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -76.24 -7.83 18.26 Favored 'Trans proline' 0 C--N 1.382 2.329 0 CA-C-N 121.18 1.457 . . . . 75.4 113.954 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.486 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 92.5 m-85 -90.01 -30.91 17.45 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 122.518 0.327 . . . . 75.21 111.769 -175.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.519 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 63.5 mtt -67.53 -75.78 0.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 122.969 0.508 . . . . 74.2 111.817 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.7 t70 179.64 169.74 1.11 Allowed 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 104.96 -2.237 . . . . 54.54 104.96 -172.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.07 -40.04 47.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 119.04 0.836 . . . . 71.53 110.852 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.49 -41.7 72.33 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.225 0.536 . . . . 73.34 111.027 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 4.2 tpt -69.97 -26.84 64.29 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 114.96 -1.018 . . . . 72.51 111.22 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -69.14 -42.69 75.66 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.477 0.711 . . . . 74.44 111.552 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -65.0 -34.56 78.72 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.562 0.539 . . . . 72.34 111.116 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.6 tp -66.11 -48.99 69.08 Favored 'General case' 0 C--O 1.216 -0.694 0 O-C-N 123.888 0.743 . . . . 73.31 110.444 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.747 ' HB2' HG21 ' A' ' 27' ' ' ILE . . . -58.85 -41.01 85.97 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.628 1.171 . . . . 71.4 114.06 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -67.03 -34.89 78.69 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.337 0.398 . . . . 73.31 111.69 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -76.27 -34.23 59.14 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 74.01 111.443 178.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.428 HG23 HD13 ' A' ' 49' ' ' ILE . 7.5 m -65.85 -37.09 85.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.072 0.549 . . . . 61.14 110.741 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.74 -34.05 75.14 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.343 0.868 . . . . 74.01 113.343 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.18 -22.02 62.08 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.903 0.382 . . . . 74.22 111.62 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -88.5 -29.73 19.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.083 -0.508 . . . . 75.24 111.509 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.678 HG21 ' HD3' ' A' ' 20' ' ' LYS . 25.6 mt -91.95 -24.81 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 111.357 0.132 . . . . 75.2 111.357 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.02 -46.49 97.6 Favored Pre-proline 0 CA--C 1.557 1.213 0 N-CA-C 114.699 1.37 . . . . 73.53 114.699 177.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -80.31 3.89 7.28 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 121.64 1.56 . . . . 74.43 114.748 176.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.528 HD23 ' HG2' ' A' ' 56' ' ' GLU . 78.9 mt -88.79 169.14 11.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.444 -0.576 . . . . 74.12 109.444 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.5 p -103.58 174.27 5.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.376 -0.374 . . . . 73.51 110.314 173.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.442 ' OE2' ' HA3' ' A' ' 19' ' ' GLY . 54.4 tp10 -66.1 -36.51 83.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.886 -0.597 . . . . 74.43 110.565 175.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.483 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 52.0 m-80 -74.12 -32.68 63.29 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.828 -0.624 . . . . 75.22 111.859 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.528 ' HG2' HD23 ' A' ' 52' ' ' LEU . 8.0 tp10 -65.75 -37.03 85.25 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.805 0.442 . . . . 75.22 111.769 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.722 ' HH ' HD12 ' A' ' 62' ' ' ILE . 45.6 t80 -69.83 -32.95 71.65 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.4 -0.363 . . . . 74.03 110.654 176.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.25 -22.86 57.54 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.123 0.416 . . . . 63.21 112.123 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 13.9 mm-40 -68.0 -39.03 83.31 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.825 -0.435 . . . . 74.01 109.825 171.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.432 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 74.9 mt -71.58 -57.06 4.74 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 115.537 -0.756 . . . . 75.31 110.631 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 59.41 20.46 8.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.238 1.415 . . . . 73.15 112.788 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.722 HD12 ' HH ' ' A' ' 57' ' ' TYR . 5.2 mp 56.63 88.37 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 124.767 1.227 . . . . 74.44 110.066 -167.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.432 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 55.5 m-85 -68.44 -42.04 79.44 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.44 -0.8 . . . . 74.1 111.344 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.4 ' HB2' HD13 ' A' ' 6' ' ' ILE . . . -122.21 106.8 11.46 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.774 -0.648 . . . . 51.44 111.926 -171.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -143.14 -1.66 1.05 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.679 -0.692 . . . . 63.23 109.946 169.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -100.69 -32.62 10.64 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.747 -0.661 . . . . 74.14 111.792 -169.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -18.23 54.51 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.094 0.405 . . . . 73.43 112.094 -179.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 m -87.06 2.57 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 120.756 0.312 . . . . 75.1 111.804 172.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.94 4.84 52.08 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.221 -0.445 . . . . 75.41 110.677 173.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -70.95 -32.36 69.21 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.338 0.655 . . . . 75.55 109.589 170.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -59.21 123.14 15.69 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 114.932 -1.031 . . . . 75.34 110.353 174.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -75.53 144.83 41.74 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.542 -0.754 . . . . 74.44 110.232 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.1 m80 72.57 115.61 0.05 Allowed 'General case' 0 N--CA 1.487 1.38 0 O-C-N 125.118 1.511 . . . . 75.51 111.118 -174.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -89.75 176.93 6.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.297 -0.865 . . . . 73.53 110.73 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -123.82 46.98 2.12 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.519 -0.764 . . . . 75.51 110.412 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 24.4 t60 . . . . . 0 N--CA 1.484 1.247 0 C-N-CA 124.965 1.306 . . . . 72.34 110.678 -177.387 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.488 ' HG3' HD23 ' A' ' 60' ' ' LEU . 27.1 ttt . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.008 -0.367 . . . . 71.14 110.008 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.9 pt -80.06 134.63 27.1 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 109.463 -0.569 . . . . 71.22 109.463 173.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -97.15 97.47 9.22 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.234 -0.654 . . . . 75.43 109.234 -177.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 76.1 mt -98.34 161.56 13.63 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.968 -1.015 . . . . 75.45 109.613 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 t -99.31 -174.49 2.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.916 -0.772 . . . . 75.43 108.916 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.5 HG21 ' HB2' ' A' ' 67' ' ' GLU . 4.1 mp -63.85 -30.9 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.645 0.778 . . . . 73.24 112.324 -171.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -65.5 -47.17 76.91 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.642 0.377 . . . . 73.03 111.462 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 2.2 mp0 -68.38 -37.1 80.08 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.403 0.439 . . . . 65.42 111.542 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.4 m -73.73 -29.5 62.28 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 123.292 0.37 . . . . 73.14 111.478 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -69.55 -35.32 75.33 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.858 0.463 . . . . 73.53 110.461 173.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.522 HD22 ' HA ' ' A' ' 42' ' ' ALA . 14.3 tp -67.23 -40.24 86.34 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.813 174.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.619 ' HA ' HD13 ' A' ' 23' ' ' LEU . 88.5 mt -61.34 -38.95 88.78 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.763 0.665 . . . . 74.3 110.824 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 t -64.21 -34.01 77.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.114 0.966 . . . . 71.14 112.259 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 88.4 mt -74.29 -43.63 49.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 O-C-N 123.299 0.375 . . . . 75.15 111.228 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.481 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 78.9 m-85 -109.61 21.79 16.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.273 0.842 . . . . 75.01 113.273 -167.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.3 t30 -87.1 114.66 23.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.268 0.556 . . . . 74.52 111.361 -177.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.458 ' HB2' ' HA3' ' A' ' 22' ' ' GLY . 28.0 mm-40 -97.82 6.12 48.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.369 -0.832 . . . . 74.11 111.624 176.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.51 51.8 1.18 Allowed Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.914 -0.874 . . . . 61.13 110.914 -175.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.55 167.47 11.72 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.826 -0.509 . . . . 64.2 111.826 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.39 -18.12 57.59 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 111.918 0.34 . . . . 72.23 111.918 -176.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.465 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 48.0 ttm-85 -64.72 -44.1 91.29 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.514 -0.766 . . . . 64.32 109.776 176.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.458 ' HA3' ' HB2' ' A' ' 17' ' ' GLU . . . -61.22 -31.61 77.6 Favored Glycine 0 C--N 1.341 0.838 0 O-C-N 124.014 0.821 . . . . 62.41 113.612 174.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.619 HD13 ' HA ' ' A' ' 12' ' ' LEU . 3.9 mm? -65.81 -43.63 88.09 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 122.548 0.339 . . . . 73.31 111.703 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 54.4 mtt -73.64 -35.4 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.156 0.428 . . . . 75.21 112.156 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 47.1 mm-40 -65.54 -50.35 65.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.647 0.261 . . . . 74.32 111.41 175.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.481 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.4 m-80 -69.71 -42.48 73.98 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.167 0.802 . . . . 63.35 113.167 -174.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 54.9 mt -68.73 -48.53 70.78 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.591 0 CA-C-O 118.84 -0.6 . . . . 74.33 111.763 -178.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -66.63 -30.19 70.41 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.361 0.875 . . . . 72.31 113.361 -175.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.29 -37.86 25.21 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.679 0.251 . . . . 62.35 111.679 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.697 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.43 19.09 15.06 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.579 0.585 . . . . 73.14 112.579 -174.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 51.6 mt -56.32 -51.99 76.61 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-O 118.12 -0.943 . . . . 71.0 112.48 173.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.5 -15.53 45.33 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.025 1.817 . . . . 71.52 114.027 174.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.697 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.7 m-85 -90.88 -5.01 56.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.941 0.496 . . . . 72.1 111.267 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 60.3 mtt -84.2 171.73 12.53 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.019 -0.363 . . . . 73.15 110.019 173.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -77.34 0.14 Allowed 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.384 -0.371 . . . . 74.3 111.216 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -175.94 -47.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.11 0.964 . . . . 70.11 108.779 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.6 -42.41 82.49 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.11 -0.95 . . . . 64.34 109.912 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 2.0 tpt -71.65 -27.04 62.81 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.574 -0.739 . . . . 72.3 111.572 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 39' ' ' ARG . 42.2 ttm180 -74.98 -46.58 34.37 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.022 0.529 . . . . 75.22 111.591 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -62.89 -34.41 77.36 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.069 0.461 . . . . 73.02 111.471 175.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 tp -66.72 -41.63 87.62 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.224 -0.898 . . . . 74.54 110.902 175.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.522 ' HA ' HD22 ' A' ' 11' ' ' LEU . . . -63.64 -38.11 89.88 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.456 0.909 . . . . 75.54 113.456 -175.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -64.12 -42.91 96.66 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 123.636 0.585 . . . . 74.42 111.178 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -73.02 -34.6 66.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.709 -0.678 . . . . 74.3 112.334 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 49' ' ' ILE . 35.0 m -71.34 -41.39 69.88 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.599 -0.273 . . . . 73.11 110.971 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.2 mt -65.36 -29.38 70.1 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.656 0.613 . . . . 63.51 112.656 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.08 -19.74 62.43 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.156 0.428 . . . . 72.24 112.156 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -29.21 22.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.316 0.246 . . . . 72.43 111.609 176.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 45' ' ' THR . 4.2 mt -90.17 -14.79 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-O 120.851 0.358 . . . . 65.01 110.683 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -47.02 99.41 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 114.013 1.116 . . . . 72.33 114.013 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -75.58 7.05 3.26 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 121.675 1.583 . . . . 74.32 114.484 172.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.3 mt -106.19 174.26 5.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.886 0.374 . . . . 74.51 110.517 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.6 p -112.01 -168.11 1.27 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.69 -0.856 . . . . 75.31 108.69 167.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.36 -7.8 57.35 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.534 -0.173 . . . . 70.21 110.534 175.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -72.93 -47.73 43.14 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.703 -0.48 . . . . 73.0 109.703 170.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -71.27 -29.43 65.06 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.534 . . . . 74.4 111.701 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -69.42 -36.92 77.16 Favored 'General case' 0 C--O 1.217 -0.629 0 O-C-N 123.278 0.361 . . . . 75.33 110.597 174.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.16 -17.48 60.91 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.031 0.382 . . . . 72.41 112.031 -177.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -66.76 -37.29 84.33 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.117 -0.492 . . . . 74.23 110.826 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.545 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 43.2 mt -83.26 -59.65 2.4 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.72 -0.673 . . . . 72.24 110.799 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.87 -107.22 0.35 Allowed 'General case' 0 C--N 1.344 0.361 0 O-C-N 125.251 1.594 . . . . 75.45 110.67 -171.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 31.2 mm -126.1 98.64 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.674 -0.862 . . . . 73.05 108.674 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.545 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 4.7 m-85 -91.87 -85.94 0.24 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.172 -0.467 . . . . 71.11 111.927 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' ' HA ' ' A' ' 6' ' ' ILE . . . -96.5 82.83 3.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.264 0.554 . . . . 75.2 110.99 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -135.44 5.25 3.19 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.577 -0.738 . . . . 65.42 110.124 173.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -96.14 9.75 39.92 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.276 -0.875 . . . . 64.51 110.547 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.5 ' HB2' HG21 ' A' ' 6' ' ' ILE . 7.9 mm-40 -94.87 -3.32 49.0 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.338 -0.846 . . . . 70.41 110.623 178.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -102.47 11.16 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.201 -0.454 . . . . 65.44 111.018 176.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.2 mt -79.89 -23.19 42.03 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.886 0.374 . . . . 74.54 110.434 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.46 -43.06 93.3 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 124.255 1.022 . . . . 65.0 110.582 173.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -85.46 139.38 31.55 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.344 -0.844 . . . . 71.44 109.137 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -76.41 121.09 22.55 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.193 0.521 . . . . 70.12 110.703 -177.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -128.27 109.91 11.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.886 -1.052 . . . . 61.44 110.271 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -80.88 95.53 6.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.923 0.868 . . . . 74.0 109.637 177.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -161.34 -51.23 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 113.933 -1.485 . . . . 74.23 107.58 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 75.2 t60 . . . . . 0 C--O 1.236 0.36 0 CA-C-N 115.023 -0.99 . . . . 74.32 108.522 177.501 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 120.655 0.264 . . . . 73.12 110.614 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.9 tt -92.03 141.82 13.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 108.98 -0.748 . . . . 74.22 108.98 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -94.27 92.54 7.27 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 121.426 0.632 . . . . 71.51 109.316 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.0 mt -105.83 152.36 23.34 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 114.919 -1.037 . . . . 74.02 108.624 171.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -74.01 156.94 37.0 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.584 -0.735 . . . . 73.21 109.519 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.884 HG21 ' HB2' ' A' ' 67' ' ' GLU . 6.1 mm -64.24 -32.85 59.13 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 122.64 0.376 . . . . 72.05 111.142 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -69.7 -34.66 74.21 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.14 -0.482 . . . . 74.24 111.211 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.476 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 39.0 mt-10 -69.71 -41.82 74.86 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.584 0.553 . . . . 73.33 111.199 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.487 ' HA ' HD12 ' A' ' 12' ' ' LEU . 2.3 m -75.35 -24.89 57.38 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.482 0.489 . . . . 65.41 111.506 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.46 -36.74 81.75 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.259 -0.276 . . . . 75.44 110.863 169.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.512 HD12 ' HG2' ' A' ' 38' ' ' MET . 46.2 tp -64.66 -36.52 84.53 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.069 0.548 . . . . 64.3 110.074 173.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.761 ' HA ' HD11 ' A' ' 23' ' ' LEU . 81.7 mt -67.11 -39.64 86.71 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.259 -0.882 . . . . 74.41 111.091 173.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.416 ' HA ' HD11 ' A' ' 62' ' ' ILE . 22.8 t -69.41 -26.16 64.49 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.964 0.906 . . . . 75.52 112.919 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 73.8 mt -79.38 -35.23 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 122.277 0.231 . . . . 62.43 110.622 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -114.96 24.64 11.55 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.913 0.709 . . . . 74.23 112.913 -173.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -85.26 90.48 7.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.384 0.611 . . . . 54.23 110.112 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -114.67 -25.22 8.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.922 -1.035 . . . . 73.1 111.275 -176.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -169.87 64.86 0.17 Allowed Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.004 -1.093 . . . . 41.34 113.489 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.16 -155.49 47.67 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 111.608 -0.597 . . . . 65.53 111.608 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.487 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 2.6 pptp? -83.51 -11.71 57.12 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.211 0.505 . . . . 75.11 110.324 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 ttp85 -68.35 -53.27 25.21 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.194 -0.669 . . . . 74.31 109.194 170.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.9 -32.93 76.44 Favored Glycine 0 C--N 1.342 0.898 0 O-C-N 124.392 1.058 . . . . 73.31 113.442 173.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.761 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.6 mm? -68.14 -49.71 59.29 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 117.11 0.455 . . . . 70.42 112.196 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.478 ' HG2' HD22 ' A' ' 46' ' ' LEU . 50.7 mtt -66.72 -34.16 77.23 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.518 0.562 . . . . 72.14 112.518 -176.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -70.07 -51.22 33.7 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.33 0.252 . . . . 75.41 111.556 175.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -76.66 -29.25 56.3 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.997 0.74 . . . . 72.41 112.997 -170.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.47 HD12 HD13 ' A' ' 23' ' ' LEU . 60.6 mt -69.04 -50.45 53.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 117.88 0.309 . . . . 75.42 110.447 175.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -67.61 -33.33 74.78 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.113 0.783 . . . . 61.42 113.113 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.99 -33.48 61.86 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.776 0.322 . . . . 74.35 111.637 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.704 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.15 19.52 19.41 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.542 0.571 . . . . 73.32 112.542 -176.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.1 mt -56.4 -50.12 89.47 Favored Pre-proline 0 CA--C 1.55 0.947 0 CA-C-O 118.266 -0.873 . . . . 74.12 112.502 171.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.99 -23.6 53.87 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 121.656 1.57 . . . . 74.44 113.923 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.704 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.0 m-85 -77.78 -36.46 50.43 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.803 0.441 . . . . 65.33 111.628 -177.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.3 ptp -82.21 168.81 17.28 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.714 0.292 . . . . 74.44 110.787 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -72.28 154.27 41.07 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.872 -0.603 . . . . 73.11 109.521 176.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -70.44 -20.19 62.92 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.673 0.619 . . . . 73.44 112.673 -175.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -65.77 -44.8 84.73 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.006 0.431 . . . . 72.33 110.415 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' MET . . . . . 0.512 ' HG2' HD12 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -76.27 -25.16 54.67 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.034 -0.985 . . . . 75.52 111.009 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -71.86 -44.71 63.34 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.3 1.04 . . . . 72.13 111.471 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -71.26 -29.95 65.71 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.742 0.417 . . . . 74.1 111.462 174.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -61.57 -34.05 74.92 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.201 -0.909 . . . . 75.35 111.381 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.48 75.89 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.548 0.944 . . . . 72.14 113.548 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.07 -38.8 92.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 74.5 110.434 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 44' ' ' ARG . 39.3 mtt180 -71.32 -53.53 13.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.959 -1.019 . . . . 54.14 112.213 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.8 m -61.41 -44.97 96.21 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.651 0.78 . . . . 70.15 112.733 -172.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.478 HD22 ' HG2' ' A' ' 24' ' ' MET . 96.3 mt -64.94 -27.43 68.84 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.783 0.661 . . . . 72.21 112.783 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.4 64.43 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.857 0.688 . . . . 73.43 112.857 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.32 -27.6 29.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.693 0.224 . . . . 72.31 110.997 177.429 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.44 ' HA ' HD13 ' A' ' 52' ' ' LEU . 3.0 mt -97.17 -12.09 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-O 121.041 0.448 . . . . 74.22 110.904 -173.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.12 97.57 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 114.341 1.237 . . . . 73.13 114.341 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -79.51 11.23 2.75 Favored 'Trans proline' 0 C--N 1.383 2.361 0 CA-C-N 122.152 1.804 . . . . 73.43 114.307 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 49' ' ' ILE . 95.8 mt -108.29 -179.66 3.95 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 122.762 0.425 . . . . 74.22 110.118 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.448 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 6.4 t -139.11 -169.95 2.77 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.471 -0.937 . . . . 74.34 108.471 174.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -64.79 -43.39 93.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.53 0.732 . . . . 73.23 112.7 -167.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.448 ' OD1' HG21 ' A' ' 53' ' ' THR . 30.7 p-10 -67.78 -32.45 73.03 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.678 0.612 . . . . 72.43 112.285 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -67.17 -41.64 85.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 123.733 0.646 . . . . 72.13 111.844 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.582 ' HE1' HD11 ' A' ' 12' ' ' LEU . 88.5 t80 -75.29 -38.46 60.36 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.477 0.486 . . . . 75.42 111.467 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.81 -24.04 66.83 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.807 1.04 . . . . 71.45 113.807 -168.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.08 -34.08 43.92 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.584 0.216 . . . . 73.3 111.584 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 mt -75.85 -56.38 4.73 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.238 -0.653 . . . . 74.55 109.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.58 -108.52 0.42 Allowed 'General case' 0 C--N 1.346 0.425 0 O-C-N 125.498 1.749 . . . . 74.32 113.17 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.416 HD11 ' HA ' ' A' ' 13' ' ' SER . 17.1 mm -113.2 88.31 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.072 -1.085 . . . . 72.33 108.072 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -103.64 -10.64 18.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.48 -0.782 . . . . 71.41 112.01 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.445 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -146.44 82.04 1.58 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 55.54 111.339 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -133.63 19.48 3.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.552 -0.749 . . . . 72.43 109.192 170.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -78.98 -42.76 25.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.967 -1.015 . . . . 72.32 111.201 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.884 ' HB2' HG21 ' A' ' 6' ' ' ILE . 24.6 mm-40 -80.71 -14.43 58.13 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.894 0.702 . . . . 72.31 112.894 -174.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -91.74 2.76 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 111.918 0.34 . . . . 63.44 111.918 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.2 mt -76.39 145.29 39.49 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.389 -0.369 . . . . 75.22 110.245 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 76.72 -20.66 0.36 Allowed 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 126.194 1.797 . . . . 75.42 111.791 -171.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 44.9 m80 -85.67 73.78 10.37 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.076 0.55 . . . . 70.01 111.129 -178.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 53.66 51.06 15.76 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.283 1.433 . . . . 74.11 112.387 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -79.25 135.66 36.83 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.177 -0.92 . . . . 75.34 109.675 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 -68.68 136.44 52.91 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.581 -0.736 . . . . 75.14 109.899 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -66.22 113.74 4.79 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.61 0.569 . . . . 72.35 109.872 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 16.1 t60 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.712 -0.676 . . . . 73.21 110.386 -174.378 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 109.231 -0.655 . . . . 72.54 109.231 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.6 pt -104.59 154.38 6.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-N 115.892 -0.594 . . . . 75.54 110.501 177.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -93.71 112.09 23.89 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 107.85 -1.167 . . . . 74.43 107.85 178.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.547 HD23 ' HG3' ' A' ' 48' ' ' LYS . 85.7 mt -98.12 159.46 14.92 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.119 -0.946 . . . . 72.3 111.527 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.451 HG21 ' HG2' ' A' ' 8' ' ' GLU . 14.9 t -90.3 166.78 13.13 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.389 -0.823 . . . . 71.53 109.004 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.3 mm -69.41 -27.35 33.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 116.228 -0.442 . . . . 71.41 110.715 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.54 -45.59 78.9 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.592 0.757 . . . . 71.21 112.378 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.451 ' HG2' HG21 ' A' ' 5' ' ' THR . 43.0 mm-40 -64.29 -43.91 93.27 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.556 0.535 . . . . 65.52 110.362 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.684 ' HA ' HD12 ' A' ' 12' ' ' LEU . 3.1 m -73.46 -26.54 60.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.777 -1.101 . . . . 61.21 111.325 -176.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.437 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.8 t-20 -69.44 -36.51 76.71 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.005 0.522 . . . . 73.14 111.45 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.623 HD12 HD13 ' A' ' 14' ' ' ILE . 38.0 tp -74.01 -33.17 63.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.879 0.371 . . . . 74.12 110.538 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.684 HD12 ' HA ' ' A' ' 9' ' ' THR . 69.4 mt -63.53 -35.32 80.07 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-N 115.634 -0.712 . . . . 74.53 110.622 170.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -70.68 -24.55 62.7 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.526 0.73 . . . . 74.23 111.988 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.623 HD13 HD12 ' A' ' 11' ' ' LEU . 96.6 mt -69.93 -34.38 59.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 123.006 0.522 . . . . 73.23 110.266 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -107.39 -84.95 0.52 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.26 -0.4 . . . . 70.53 111.309 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.598 ' HA ' HD22 ' A' ' 23' ' ' LEU . 64.3 t30 57.13 83.83 0.1 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.389 1.476 . . . . 62.0 111.829 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.412 ' H ' HD21 ' A' ' 23' ' ' LEU . 38.5 tt0 -149.53 123.63 9.46 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.763 -1.108 . . . . 72.41 110.03 -177.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.17 24.02 74.53 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 115.535 0.974 . . . . 71.42 115.535 167.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.92 -150.19 42.35 Favored Glycine 0 C--O 1.221 -0.695 0 C-N-CA 121.153 -0.546 . . . . 74.13 112.497 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 57' ' ' TYR . 14.2 tmtt? -64.97 -43.35 92.94 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.95 0.5 . . . . 74.35 111.085 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -72.81 -45.4 58.68 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.051 -0.977 . . . . 74.33 111.318 -172.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.38 -30.08 74.89 Favored Glycine 0 CA--C 1.524 0.627 0 O-C-N 123.757 0.661 . . . . 75.02 113.137 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.598 HD22 ' HA ' ' A' ' 16' ' ' ASN . 0.5 OUTLIER -64.24 -37.89 89.09 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.821 0.31 . . . . 74.23 110.905 173.664 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.626 ' HG2' HD21 ' A' ' 46' ' ' LEU . 37.8 mtt -69.42 -39.41 77.88 Favored 'General case' 0 C--O 1.221 -0.415 0 O-C-N 123.234 0.334 . . . . 74.32 111.505 175.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -63.71 -40.81 97.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.693 0.397 . . . . 72.03 111.723 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -77.98 -42.68 32.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.712 -0.676 . . . . 75.42 111.174 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.0 mt -72.63 -38.48 58.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 119.107 -0.473 . . . . 74.22 111.868 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -63.36 -35.76 81.47 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.254 0.479 . . . . 63.52 111.693 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -19.26 61.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.109 -0.496 . . . . 71.35 112.307 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.617 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -113.79 17.29 18.17 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.415 0.524 . . . . 62.53 112.415 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.51 -44.65 56.55 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 113.441 0.904 . . . . 75.22 113.441 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.26 7.95 2.74 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 121.709 1.606 . . . . 55.14 114.122 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.617 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 95.9 m-85 -114.29 -168.8 1.41 Allowed 'General case' 0 C--O 1.242 0.681 0 C-N-CA 123.12 0.568 . . . . 74.32 109.618 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 68.0 mtm 68.16 -88.81 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.309 1.444 . . . . 75.14 111.454 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -167.85 164.1 14.05 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 106.832 -1.544 . . . . 75.02 106.832 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.64 -31.71 71.91 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.043 0.383 . . . . 61.51 111.734 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.34 -39.01 55.06 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.0 0.52 . . . . 73.24 110.508 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 5.7 mtt -68.03 -28.51 67.46 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 115.914 -0.585 . . . . 64.43 111.882 174.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -71.04 -43.02 68.72 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 123.311 0.645 . . . . 75.31 111.156 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -67.98 -32.17 72.38 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 111.562 0.208 . . . . 74.33 111.562 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.72 -48.07 78.56 Favored 'General case' 0 C--O 1.213 -0.846 0 O-C-N 123.644 0.59 . . . . 74.51 109.653 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.63 -34.76 76.24 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.348 1.059 . . . . 71.32 113.537 -177.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -66.27 -35.97 81.79 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 123.688 0.617 . . . . 75.42 111.813 177.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -79.75 -28.98 40.38 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.468 0.48 . . . . 74.03 111.515 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.401 HG23 ' HZ2' ' A' ' 48' ' ' LYS . 6.6 m -75.35 -30.66 60.31 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.945 0.402 . . . . 75.43 110.39 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.626 HD21 ' HG2' ' A' ' 24' ' ' MET . 67.6 mt -76.71 -31.16 57.02 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.182 0.438 . . . . 72.23 112.182 169.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.42 -33.12 73.65 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.743 0.645 . . . . 74.45 112.743 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.547 ' HG3' HD23 ' A' ' 4' ' ' LEU . 0.1 OUTLIER -86.4 -17.21 34.95 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.914 0.339 . . . . 73.33 111.914 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.515 HG22 HD11 ' A' ' 52' ' ' LEU . 31.7 pt -97.82 -8.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 120.415 -0.514 . . . . 75.22 112.005 174.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.66 -46.32 99.59 Favored Pre-proline 0 CA--C 1.557 1.216 0 CA-C-O 118.261 -0.876 . . . . 61.34 113.208 171.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.45 -5.91 15.92 Favored 'Trans proline' 0 C--N 1.381 2.266 0 CA-C-N 121.62 1.614 . . . . 71.22 114.139 171.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.515 HD11 HG22 ' A' ' 49' ' ' ILE . 76.7 mt -92.17 153.07 19.55 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.886 0.374 . . . . 70.53 110.115 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 p -95.01 -176.89 3.97 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.982 175.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.56 -30.28 69.87 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.902 -0.59 . . . . 75.55 111.362 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -71.72 -39.4 70.16 Favored 'General case' 0 C--O 1.226 -0.183 0 O-C-N 123.724 0.64 . . . . 73.23 110.527 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.3 -42.04 93.48 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 123.716 0.635 . . . . 64.53 112.711 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.457 ' HB3' ' HB2' ' A' ' 20' ' ' LYS . 80.1 t80 -75.58 -26.15 57.65 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.052 0.22 . . . . 73.12 111.218 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.96 -29.04 66.06 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.94 0.336 . . . . 73.34 111.341 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.38 -23.44 61.11 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 123.456 0.472 . . . . 75.32 111.811 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -93.75 -69.06 0.77 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.639 0.376 . . . . 74.13 111.808 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.94 -135.02 1.46 Allowed 'General case' 0 C--N 1.352 0.709 0 C-N-CA 124.741 1.216 . . . . 72.24 110.709 -172.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.4 mm -97.1 98.0 6.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.002 -1.111 . . . . 74.52 108.002 172.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -117.45 -9.6 10.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.334 -0.848 . . . . 71.22 111.794 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.94 -29.04 3.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.462 0.542 . . . . 74.42 112.462 -173.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.81 17.51 6.57 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.901 0.704 . . . . 73.13 112.901 -174.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -82.97 -26.81 30.98 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.011 -0.54 . . . . 73.0 110.57 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -74.82 -20.19 59.88 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.819 0.674 . . . . 74.42 112.819 -174.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.4 m -88.08 -0.19 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.213 0.449 . . . . 72.24 112.213 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.2 mt -86.53 2.72 47.05 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.043 0.449 . . . . 75.21 111.182 -179.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -80.43 -17.87 50.5 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.532 -0.758 . . . . 71.42 109.985 172.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -80.17 174.63 11.41 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.012 -0.54 . . . . 74.24 110.996 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -73.18 111.55 8.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.147 -0.479 . . . . 65.52 109.882 -177.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.9 p80 -120.17 114.13 21.48 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.744 0.783 . . . . 74.41 112.436 -170.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -105.98 173.16 6.43 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.893 -1.049 . . . . 75.41 110.175 173.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.9 p80 -121.24 117.1 26.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.373 0.606 . . . . 61.33 109.972 171.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.761 -0.654 . . . . 70.24 109.932 179.33 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 N--CA 1.477 0.922 0 CA-C-O 120.869 0.366 . . . . 72.3 110.115 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.601 HD13 ' HD2' ' A' ' 48' ' ' LYS . 11.0 pt -127.07 166.94 22.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.435 -0.802 . . . . 74.51 110.466 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -103.91 112.99 26.2 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.548 0.689 . . . . 71.4 111.104 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.8 mt -91.83 148.31 22.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.271 -1.332 . . . . 72.14 110.401 -179.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.8 p -87.33 169.8 11.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.163 -0.471 . . . . 70.22 110.836 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 50.5 mt -70.8 -22.49 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.743 -0.662 . . . . 71.45 109.803 177.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.42 -55.04 27.54 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.136 0.575 . . . . 74.33 111.22 174.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.01 -37.33 69.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.675 -0.693 . . . . 72.32 111.912 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.729 ' HA ' HD12 ' A' ' 12' ' ' LEU . 7.6 m -74.75 -27.82 60.51 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.402 -0.363 . . . . 74.31 111.89 -179.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -65.25 -38.22 89.66 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 122.198 -0.314 . . . . 74.04 110.524 174.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.526 ' HA ' HD11 ' A' ' 14' ' ' ILE . 21.3 tp -70.65 -32.55 69.88 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.619 0.574 . . . . 73.23 111.023 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.729 HD12 ' HA ' ' A' ' 9' ' ' THR . 86.9 mt -61.91 -40.92 97.12 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.868 -0.605 . . . . 63.54 111.178 171.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 t -71.5 -27.55 63.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.312 0.645 . . . . 64.4 112.093 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.526 HD11 ' HA ' ' A' ' 11' ' ' LEU . 75.6 mt -63.79 -37.5 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.395 0.678 . . . . 73.12 111.116 176.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -94.88 -87.75 0.26 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 119.584 -0.246 . . . . 74.54 110.449 175.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.419 ' HA ' HD22 ' A' ' 23' ' ' LEU . 58.2 t30 50.28 66.46 1.14 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.809 1.244 . . . . 73.32 111.798 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -85.49 -75.87 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.564 -0.744 . . . . 75.14 110.806 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -141.8 66.62 0.48 Allowed Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 111.437 -0.665 . . . . 34.31 111.437 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.68 -160.11 37.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.411 -0.424 . . . . 74.22 112.117 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.607 ' HE2' HG21 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -70.4 -29.4 66.01 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.567 0.58 . . . . 72.12 112.567 -174.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.9 mtt180 -71.5 -44.78 64.06 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 123.165 0.291 . . . . 71.44 110.434 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.69 -27.34 68.11 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 123.552 0.533 . . . . 74.23 112.828 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 23' ' ' LEU . 1.2 mm? -71.41 -56.44 5.95 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-O 119.403 -0.332 . . . . 73.45 111.884 172.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 97.6 mtp -72.2 -35.99 69.09 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.574 0.583 . . . . 61.41 112.574 -169.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.3 -45.67 86.96 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.121 0.568 . . . . 65.43 112.202 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -78.36 -24.44 46.45 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.166 0.432 . . . . 65.43 112.166 -177.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.766 HG22 ' HB3' ' A' ' 42' ' ' ALA . 20.8 mt -67.01 -46.52 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 119.59 -0.243 . . . . 73.31 110.648 173.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -66.2 -33.73 76.43 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.501 0.556 . . . . 74.11 112.501 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.01 -36.17 59.25 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 123.458 0.473 . . . . 62.31 112.145 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.703 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.28 21.07 18.06 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.966 0.728 . . . . 74.01 112.966 -172.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.476 ' HB2' ' HD3' ' A' ' 32' ' ' PRO . 79.1 mt -52.27 -53.21 55.17 Favored Pre-proline 0 CA--C 1.56 1.347 0 N-CA-C 113.402 0.889 . . . . 74.34 113.402 173.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 31' ' ' LEU . 7.3 Cg_exo -76.33 -13.14 18.84 Favored 'Trans proline' 0 C--N 1.381 2.255 0 C-N-CA 121.982 1.788 . . . . 75.53 113.681 177.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.703 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.8 m-85 -81.49 -21.98 38.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.86 0.362 . . . . 74.23 110.742 177.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.0 mtm -84.52 163.82 19.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.863 -0.608 . . . . 71.22 110.63 171.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -85.37 177.78 7.68 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.83 -0.623 . . . . 73.11 110.518 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -42.71 -52.1 5.05 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 126.232 1.813 . . . . 75.44 114.078 -176.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -68.55 -50.59 50.71 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.301 0.64 . . . . 74.15 111.441 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 62.6 mtt -70.46 -27.43 64.23 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 124.006 0.816 . . . . 51.33 112.769 -172.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -65.84 -50.88 63.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.526 0.73 . . . . 73.43 111.12 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.16 -32.4 63.11 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.801 0.667 . . . . 72.55 112.801 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -69.17 -28.73 66.67 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.164 0.585 . . . . 75.25 110.777 178.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.766 ' HB3' HG22 ' A' ' 27' ' ' ILE . . . -66.12 -36.23 82.61 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 112.655 0.613 . . . . 64.53 112.655 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.86 -33.07 74.04 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 123.398 0.436 . . . . 74.14 111.591 176.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.414 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 79.4 mtp180 -68.32 -39.12 82.1 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.646 -0.706 . . . . 75.32 110.81 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.458 ' O ' HG13 ' A' ' 49' ' ' ILE . 6.9 m -73.65 -35.06 65.22 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.745 -0.661 . . . . 71.41 111.064 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 79.3 mt -62.47 -38.14 88.67 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.566 0.346 . . . . 73.2 111.534 173.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.61 -15.32 62.74 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.338 -0.847 . . . . 44.32 112.43 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.601 ' HD2' HD13 ' A' ' 2' ' ' ILE . 46.5 mmtm -88.36 -42.03 12.46 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.505 0.558 . . . . 72.43 112.505 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.607 HG21 ' HE2' ' A' ' 20' ' ' LYS . 6.5 mt -83.26 -25.26 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 117.838 0.29 . . . . 74.2 111.736 -172.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.1 -45.84 73.01 Favored Pre-proline 0 CA--C 1.552 1.019 0 N-CA-C 113.801 1.037 . . . . 75.31 113.801 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -76.0 -6.26 17.19 Favored 'Trans proline' 0 C--N 1.376 2.011 0 CA-C-N 122.194 1.819 . . . . 71.43 114.212 174.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.3 mt -90.96 162.38 14.77 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.033 0.444 . . . . 74.23 109.986 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.431 HG22 ' HG3' ' A' ' 56' ' ' GLU . 14.5 t -93.33 174.64 7.11 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 109.495 -0.558 . . . . 60.51 109.495 170.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.51 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 12.8 pt-20 -68.2 -26.89 65.96 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.202 0.601 . . . . 74.11 112.173 -179.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -74.34 -40.53 62.11 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 122.242 0.217 . . . . 75.45 110.863 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.431 ' HG3' HG22 ' A' ' 53' ' ' THR . 48.8 mt-10 -66.67 -37.23 84.35 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.46 0.475 . . . . 75.41 112.254 -177.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -70.11 -36.26 74.71 Favored 'General case' 0 C--O 1.217 -0.653 0 O-C-N 123.299 0.374 . . . . 73.24 110.742 175.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.99 -24.99 60.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.27 0.471 . . . . 74.44 112.27 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.15 -29.99 64.58 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.364 0.265 . . . . 74.42 111.17 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.2 mt -84.86 -43.57 14.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.126 -0.488 . . . . 70.12 110.231 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.85 -110.37 0.56 Allowed 'General case' 0 C--N 1.347 0.491 0 O-C-N 125.341 1.651 . . . . 73.54 110.994 -173.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 46.6 mm -110.93 94.95 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 106.926 -1.509 . . . . 71.31 106.926 168.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -80.32 -62.59 1.63 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.33 -1.305 . . . . 74.34 111.547 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.571 ' H ' HG21 ' A' ' 9' ' ' THR . . . -126.2 86.27 2.5 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.149 0.5 . . . . 75.31 111.438 -178.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -145.71 -5.34 0.64 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 73.04 111.109 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -90.86 25.17 2.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.494 0.664 . . . . 75.22 110.764 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -107.29 -30.78 8.52 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.403 -0.817 . . . . 72.34 109.713 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 m -105.96 32.78 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.479 -0.782 . . . . 71.31 112.314 -171.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.19 -4.79 49.43 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.867 -0.606 . . . . 75.53 111.214 177.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -86.54 -1.14 57.37 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.388 0.675 . . . . 72.12 110.788 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -68.03 103.05 1.41 Allowed 'General case' 0 C--N 1.343 0.326 0 CA-C-O 121.306 0.574 . . . . 74.41 109.91 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -141.36 114.94 8.95 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.96 -1.018 . . . . 75.24 108.483 -173.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -77.54 110.85 12.68 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 122.41 1.1 . . . . 73.12 111.097 -175.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 36.6 t-80 -149.88 91.75 1.82 Allowed 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 106.669 -1.604 . . . . 74.15 106.669 169.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -89.14 67.6 8.02 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 114.847 -1.069 . . . . 64.41 109.44 -175.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 63.4 m80 . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 124.837 1.255 . . . . 73.43 112.089 -176.788 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.481 1.109 0 CA-C-O 120.809 0.338 . . . . 73.31 110.443 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.678 HD11 ' HB2' ' A' ' 48' ' ' LYS . 10.2 tt -123.98 138.6 53.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 109.307 -0.627 . . . . 75.13 109.307 170.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -91.19 121.06 32.64 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.33 -0.395 . . . . 73.51 111.621 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.415 HD11 ' HZ3' ' A' ' 48' ' ' LYS . 3.9 mp -135.06 -176.17 4.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.839 -0.619 . . . . 72.35 110.65 177.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.01 171.38 8.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 116.068 -0.515 . . . . 74.23 110.37 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.861 HG21 ' HB2' ' A' ' 67' ' ' GLU . 17.0 mm -57.84 -47.15 86.86 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.627 0 C-N-CA 123.78 0.832 . . . . 72.55 111.517 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -60.21 -36.04 76.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.567 0.747 . . . . 70.01 112.64 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.549 ' HG2' HD12 ' A' ' 41' ' ' LEU . 32.7 mt-10 -75.17 -41.09 58.85 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.933 0.493 . . . . 72.15 111.495 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.8 m -76.64 -28.0 55.87 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 116.18 -0.464 . . . . 62.21 111.639 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -71.63 -26.21 62.47 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.097 0.559 . . . . 72.34 111.267 173.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 42' ' ' ALA . 50.6 tp -66.21 -31.01 71.58 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 122.628 0.371 . . . . 74.05 111.204 173.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.501 HD23 HD21 ' A' ' 23' ' ' LEU . 83.7 mt -60.36 -32.5 71.34 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.248 -0.433 . . . . 62.31 111.355 173.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -69.47 -25.58 64.15 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.286 0.635 . . . . 72.2 112.329 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.9 mm -69.18 -44.96 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 122.899 0.48 . . . . 73.13 111.125 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.402 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 82.9 m-85 -120.23 19.29 12.2 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.982 0.734 . . . . 74.23 112.982 -172.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.451 HD21 HD12 ' A' ' 62' ' ' ILE . 31.4 t-20 -67.88 106.98 2.47 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.077 0.465 . . . . 64.23 109.999 178.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -145.07 96.38 2.84 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.894 -1.048 . . . . 75.44 108.279 -178.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.46 42.68 32.98 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 120.697 -0.763 . . . . 75.23 111.901 -173.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.52 -138.46 21.72 Favored Glycine 0 N--CA 1.447 -0.589 0 O-C-N 123.833 0.373 . . . . 63.22 112.474 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.719 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 2.2 pptp? -95.72 -7.96 35.88 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.796 0.351 . . . . 74.55 111.253 -177.535 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -63.92 -60.28 3.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.801 -0.636 . . . . 73.51 110.318 174.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -27.93 71.58 Favored Glycine 0 C--O 1.223 -0.579 0 CA-C-N 115.702 -0.681 . . . . 75.43 112.747 176.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.719 ' HB3' ' HA ' ' A' ' 20' ' ' LYS . 57.3 tp -59.98 -44.35 94.55 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.397 0.679 . . . . 73.33 111.406 175.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 46.5 mtt -64.16 -46.99 81.6 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.232 0.456 . . . . 72.35 112.232 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -63.79 -41.68 97.89 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 123.762 0.664 . . . . 75.44 111.339 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.402 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 20.5 m-80 -71.83 -38.05 70.23 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 112.508 0.559 . . . . 72.42 112.508 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.5 mt -70.04 -44.52 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 119.301 -0.38 . . . . 72.15 111.563 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -65.65 -35.58 81.21 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.283 0.475 . . . . 63.4 112.283 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.48 -29.99 64.13 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 123.207 0.317 . . . . 75.54 111.578 177.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.736 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -99.98 16.41 24.01 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.519 0.563 . . . . 73.23 112.519 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.2 mt -67.28 -44.81 48.9 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.618 -0.706 . . . . 74.01 112.065 172.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.8 12.61 0.69 Allowed 'Trans proline' 0 C--N 1.377 2.065 0 CA-C-N 121.759 1.664 . . . . 74.42 113.911 169.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.736 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.4 m-85 -124.47 -154.92 0.64 Allowed 'General case' 0 C--O 1.239 0.517 0 C-N-CA 123.72 0.808 . . . . 73.55 109.222 177.117 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 70.8 mtm 67.47 -94.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.297 1.439 . . . . 74.3 112.796 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -174.74 147.58 1.04 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.479 -1.675 . . . . 72.12 106.479 -166.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.04 -38.32 79.09 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 118.403 0.547 . . . . 72.42 112.168 -177.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.76 -45.25 75.44 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.18 0.514 . . . . 75.32 110.705 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 18.4 ttp -73.04 -24.34 60.7 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.302 -0.863 . . . . 75.2 111.844 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -69.22 -39.73 78.4 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.839 0.456 . . . . 74.11 111.626 173.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -61.72 -36.34 80.66 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.062 0.458 . . . . 75.11 111.188 173.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.549 HD12 ' HG2' ' A' ' 8' ' ' GLU . 27.2 tp -71.36 -39.06 71.49 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 115.285 -0.87 . . . . 75.31 111.04 176.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.551 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -66.41 -32.35 73.68 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.252 0.621 . . . . 72.11 112.322 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -65.39 -44.82 86.32 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.199 -0.91 . . . . 75.14 111.992 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -80.34 -22.11 41.79 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.88 0.696 . . . . 74.31 112.88 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.496 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 60.7 m -84.24 -27.29 28.03 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 120.816 0.341 . . . . 73.13 110.868 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 28.9 mt -66.99 -33.73 76.22 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 122.101 -0.375 . . . . 73.31 111.709 168.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.52 -20.53 60.63 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 123.584 0.553 . . . . 72.33 112.239 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.678 ' HB2' HD11 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -87.18 -25.76 23.89 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 119.484 -0.293 . . . . 75.1 111.6 178.624 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.442 HG21 HD12 ' A' ' 52' ' ' LEU . 15.4 pt -92.66 -14.76 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 112.395 0.517 . . . . 74.41 112.395 178.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.19 -48.01 97.71 Favored Pre-proline 0 CA--C 1.554 1.133 0 N-CA-C 114.639 1.348 . . . . 74.21 114.639 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.98 -1.32 11.15 Favored 'Trans proline' 0 C--N 1.38 2.215 0 CA-C-N 121.96 1.736 . . . . 74.43 113.98 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.442 HD12 HG21 ' A' ' 49' ' ' ILE . 61.4 mt -86.83 149.11 25.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.202 -0.666 . . . . 75.31 109.202 177.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 t -95.02 178.23 5.62 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 108.954 -0.758 . . . . 75.24 108.954 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -74.19 -38.79 63.53 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.746 0.308 . . . . 73.15 111.553 -172.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -72.08 -29.57 64.25 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.042 -0.526 . . . . 73.02 111.021 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -71.64 -30.94 66.31 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.208 0.603 . . . . 74.21 111.18 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -74.53 -28.22 60.87 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 110.159 -0.311 . . . . 72.52 110.159 173.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.1 -22.22 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.967 0.349 . . . . 71.05 111.7 177.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -71.23 -37.57 72.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.938 -0.574 . . . . 71.21 111.688 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.425 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 13.2 mt -85.31 -53.01 5.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.142 -0.481 . . . . 74.41 110.759 -176.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.53 -109.17 0.47 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.742 1.617 . . . . 53.23 111.136 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.451 HD12 HD21 ' A' ' 16' ' ' ASN . 47.3 mm -121.55 107.39 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 107.779 -1.193 . . . . 75.32 107.779 173.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.425 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 1.2 m-85 -97.03 -73.7 0.59 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.229 -0.441 . . . . 74.54 111.775 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.48 ' HB2' ' HA ' ' A' ' 6' ' ' ILE . . . -89.98 102.14 14.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.304 0.573 . . . . 71.12 111.111 -175.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -149.72 -179.15 6.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.139 -0.937 . . . . 71.43 108.966 178.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.8 t70 75.35 -31.14 0.2 Allowed 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 124.877 1.271 . . . . 71.05 113.331 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.861 ' HB2' HG21 ' A' ' 6' ' ' ILE . 36.7 mm-40 -70.57 -19.92 62.83 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.385 0.674 . . . . 75.44 111.781 -178.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.6 m -87.61 3.68 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.848 -0.614 . . . . 70.24 111.728 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 77.1 mt -99.23 -37.07 9.44 Favored 'General case' 0 C--O 1.226 -0.161 0 N-CA-C 110.097 -0.334 . . . . 75.21 110.097 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -67.34 -55.45 13.79 Favored 'General case' 0 C--N 1.344 0.364 0 N-CA-C 108.565 -0.902 . . . . 70.12 108.565 172.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -70.33 139.43 52.02 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.327 -0.851 . . . . 72.43 109.337 175.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 76.7 123.4 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 O-C-N 125.071 1.482 . . . . 74.43 110.48 -168.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -85.25 147.56 26.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.869 -1.06 . . . . 70.51 111.142 -173.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 50.8 p-80 -69.7 158.66 34.95 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.408 -0.815 . . . . 71.34 111.748 -175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -122.5 99.42 6.4 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.333 -0.618 . . . . 64.22 109.333 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.4 t60 . . . . . 0 CA--C 1.536 0.415 0 CA-C-N 116.206 -0.452 . . . . 72.2 109.957 -179.424 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ttt . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 110.095 -0.335 . . . . 72.22 110.095 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.711 HD12 ' HG3' ' A' ' 48' ' ' LYS . 20.8 pt -81.31 154.46 4.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 N-CA-C 109.51 -0.552 . . . . 75.51 109.51 172.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -102.17 104.23 14.8 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.695 -0.684 . . . . 74.24 109.628 -170.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.474 HD12 ' HD2' ' A' ' 48' ' ' LYS . 19.0 mt -85.51 165.45 17.11 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.766 -1.107 . . . . 55.44 109.166 178.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -82.64 172.6 12.76 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 109.356 -0.609 . . . . 72.23 109.356 176.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.769 HG21 ' HB2' ' A' ' 67' ' ' GLU . 18.8 mm -69.65 -22.31 25.07 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.557 -0.747 . . . . 73.22 111.01 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.31 -40.21 85.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.632 0.373 . . . . 72.4 111.689 175.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -65.91 -40.84 91.85 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.271 0.357 . . . . 74.31 111.213 175.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.421 HG21 ' H ' ' A' ' 64' ' ' ALA . 6.4 m -70.14 -34.77 73.46 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.958 -0.564 . . . . 70.51 111.467 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.482 ' O ' HG13 ' A' ' 14' ' ' ILE . 13.0 t30 -71.31 -30.82 66.69 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.659 0.784 . . . . 73.54 111.725 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.44 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 22.8 tp -62.29 -40.07 95.06 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 123.411 0.444 . . . . 74.11 111.086 176.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 66.1 mt -70.91 -32.47 69.41 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.336 -0.847 . . . . 73.42 111.065 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.0 t -70.62 -26.22 63.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.514 0.726 . . . . 75.51 112.435 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 10' ' ' ASN . 97.1 mt -61.77 -48.47 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 122.864 0.466 . . . . 65.34 111.319 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -98.0 -76.18 0.53 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.627 -0.261 . . . . 73.21 110.803 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.707 ' HA ' HD21 ' A' ' 23' ' ' LEU . 15.8 t-20 53.65 81.13 0.1 Allowed 'General case' 0 N--CA 1.474 0.739 0 O-C-N 124.925 1.391 . . . . 74.22 111.7 -177.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -102.57 -95.2 0.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.713 -0.395 . . . . 71.53 111.316 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.468 ' H ' ' HA3' ' A' ' 22' ' ' GLY . . . -118.59 82.35 0.33 Allowed Glycine 0 CA--C 1.501 -0.806 0 C-N-CA 120.561 -0.828 . . . . 62.13 111.687 -177.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.06 43.06 Favored Glycine 0 C--O 1.226 -0.379 0 N-CA-C 111.598 -0.601 . . . . 73.14 111.598 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 53' ' ' THR . 2.7 pptp? -89.15 -18.2 27.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.518 0.159 . . . . 73.25 110.939 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 mtt85 -66.39 -51.15 60.0 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 123.424 0.453 . . . . 75.43 110.35 173.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.468 ' HA3' ' H ' ' A' ' 18' ' ' GLY . . . -63.89 -29.16 74.01 Favored Glycine 0 C--N 1.339 0.731 0 O-C-N 123.966 0.791 . . . . 72.32 113.051 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.707 HD21 ' HA ' ' A' ' 16' ' ' ASN . 2.4 mm? -67.9 -51.86 43.04 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-O 118.656 -0.688 . . . . 75.54 111.275 173.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.576 ' HG2' HD22 ' A' ' 46' ' ' LEU . 52.8 mtt -63.81 -42.02 97.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.97 0.73 . . . . 74.11 112.97 -175.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -67.78 -38.09 82.93 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.305 0.483 . . . . 74.03 112.305 -177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -79.79 -33.11 40.8 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.277 0.473 . . . . 75.05 112.277 178.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.617 HG23 ' HE1' ' A' ' 34' ' ' MET . 30.5 mt -69.22 -47.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 118.908 -0.567 . . . . 75.12 111.374 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.515 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 35.1 m-80 -66.62 -31.13 71.63 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.368 0.507 . . . . 74.22 112.368 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.45 -31.26 60.25 Favored 'General case' 0 N--CA 1.464 0.248 0 O-C-N 123.177 0.298 . . . . 74.21 111.721 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.693 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.57 18.15 22.5 Favored 'General case' 0 C--O 1.223 -0.31 0 N-CA-C 112.689 0.626 . . . . 71.23 112.689 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.515 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 52.5 mt -55.88 -49.31 93.66 Favored Pre-proline 0 CA--C 1.554 1.106 0 N-CA-C 114.121 1.156 . . . . 73.41 114.121 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -79.99 0.14 10.24 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 121.912 1.742 . . . . 73.53 113.409 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.693 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.6 m-85 -97.73 -20.83 17.33 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.197 0.199 . . . . 74.53 111.397 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.617 ' HE1' HG23 ' A' ' 27' ' ' ILE . 64.3 mtt -75.08 -81.22 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.273 0.358 . . . . 74.41 111.234 -179.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.591 ' HB3' ' HB2' ' A' ' 38' ' ' MET . 34.9 t70 -179.08 161.59 1.15 Allowed 'General case' 0 C--N 1.338 0.079 0 N-CA-C 106.812 -1.551 . . . . 64.01 106.812 -170.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.54 -47.04 85.65 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.827 0.451 . . . . 75.04 111.326 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -76.88 -34.31 57.78 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.876 -0.602 . . . . 74.11 110.447 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' MET . . . . . 0.591 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 3.6 tpt -72.25 -25.48 61.64 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 123.824 0.703 . . . . 65.25 111.486 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.412 ' HG3' ' HB3' ' A' ' 31' ' ' LEU . 13.0 ttp180 -70.63 -40.55 73.05 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 122.417 0.287 . . . . 74.34 110.727 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.51 -30.12 64.22 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.246 0.546 . . . . 71.21 110.587 178.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.15 -34.96 71.47 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 115.067 -0.969 . . . . 73.34 110.639 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.44 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -65.14 -40.03 93.82 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 116.164 -0.471 . . . . 72.52 111.574 175.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -68.46 -30.06 68.84 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.623 0.577 . . . . 73.03 111.553 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 tpp180 -71.07 -46.97 60.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.09 0.556 . . . . 74.1 111.552 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 49' ' ' ILE . 11.2 m -70.62 -44.04 68.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.112 -0.494 . . . . 73.13 111.302 -176.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.576 HD22 ' HG2' ' A' ' 24' ' ' MET . 52.8 mt -70.48 -27.28 64.09 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.671 0.619 . . . . 73.23 112.671 -177.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.49 -29.15 70.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.754 0.311 . . . . 72.51 111.704 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.711 ' HG3' HD12 ' A' ' 2' ' ' ILE . 14.9 tmtt? -81.53 -33.22 31.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.196 -0.457 . . . . 74.1 110.51 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.508 ' HA ' HD13 ' A' ' 52' ' ' LEU . 11.4 mt -90.8 -11.51 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-O 120.835 0.35 . . . . 75.2 111.458 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.472 ' HA ' ' HE1' ' A' ' 24' ' ' MET . . . -58.78 -46.34 99.57 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 113.889 1.07 . . . . 74.32 113.889 176.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -75.66 -6.45 17.62 Favored 'Trans proline' 0 C--N 1.378 2.095 0 CA-C-N 121.76 1.664 . . . . 71.15 113.542 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.508 HD13 ' HA ' ' A' ' 49' ' ' ILE . 65.3 mt -90.11 158.22 17.39 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.603 -0.517 . . . . 74.32 109.603 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.437 HG21 ' H ' ' A' ' 55' ' ' ASN . 8.7 t -112.74 -167.37 1.18 Allowed 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.19 -0.67 . . . . 72.35 109.19 171.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.41 -29.16 69.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.122 0.569 . . . . 74.53 112.129 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.441 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 0.2 OUTLIER -65.0 -46.23 82.25 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.745 0.653 . . . . 75.3 110.348 177.143 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.453 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 2.4 mp0 -69.2 -28.79 66.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.996 0.739 . . . . 73.42 112.996 -178.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -72.45 -37.42 68.54 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 120.842 -0.343 . . . . 73.53 110.27 175.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.27 -14.04 60.48 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.436 0.532 . . . . 72.23 112.436 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 14.0 mm-40 -63.21 -31.55 72.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.084 0.469 . . . . 75.35 110.389 168.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.4 mt -89.59 -61.76 1.62 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.498 -0.774 . . . . 64.01 109.986 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.3 45.73 26.64 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 124.766 1.291 . . . . 62.42 112.495 178.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 40.9 mm 66.72 95.92 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 C-N-CA 124.796 1.238 . . . . 73.0 110.151 -174.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -85.21 -56.91 3.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.773 -1.103 . . . . 74.32 112.09 -171.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.436 ' HB1' ' OE1' ' A' ' 67' ' ' GLU . . . -114.9 -97.35 0.45 Allowed 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.934 -0.575 . . . . 73.33 111.75 -170.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.53 -33.31 0.24 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.152 1.781 . . . . 72.45 114.848 176.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.486 ' HA ' HD11 ' A' ' 69' ' ' LEU . 3.5 p30 -75.8 -17.53 59.83 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.916 0.71 . . . . 73.3 112.916 -171.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.769 ' HB2' HG21 ' A' ' 6' ' ' ILE . 29.9 mp0 -64.25 -35.96 82.52 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.386 0.674 . . . . 75.42 112.298 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.1 m -91.99 -1.69 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 111.812 0.301 . . . . 61.12 111.812 178.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 66' ' ' ASP . 84.9 mt -94.14 -58.27 2.28 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.582 -0.281 . . . . 73.4 110.495 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -151.94 -55.25 0.13 Allowed 'General case' 0 C--O 1.236 0.369 0 O-C-N 123.551 0.532 . . . . 74.13 110.172 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.721 ' HB2' ' HA ' ' A' ' 67' ' ' GLU . 49.4 t60 62.64 51.34 3.17 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 124.722 1.264 . . . . 74.34 111.041 176.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -99.48 84.97 3.06 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.787 -0.642 . . . . 74.42 109.889 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.5 t60 52.84 74.49 0.29 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.192 1.397 . . . . 72.45 111.199 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -80.45 146.5 31.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.434 -0.803 . . . . 74.33 111.38 -173.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 32.2 m80 -94.2 90.08 6.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.847 -0.615 . . . . 73.22 110.122 -175.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 . . . . . 0 N--CA 1.482 1.127 0 O-C-N 124.575 1.172 . . . . 65.05 111.279 -178.86 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.539 ' HA ' HD21 ' A' ' 60' ' ' LEU . 98.7 mmm . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 110.232 -0.284 . . . . 62.35 110.232 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.3 tt -148.73 140.78 17.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 109.013 -0.736 . . . . 73.15 109.013 175.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.478 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 9.4 mmt-85 -87.4 106.27 17.84 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.472 0.653 . . . . 75.25 110.964 178.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.536 HD22 ' HZ3' ' A' ' 48' ' ' LYS . 96.6 mt -114.12 165.58 12.51 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-N 114.699 -1.137 . . . . 73.51 110.802 -179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 153.13 27.16 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.778 -0.647 . . . . 63.11 109.979 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.41 -34.18 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.527 0.331 . . . . 74.32 110.865 176.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.1 -38.56 88.52 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.009 0.524 . . . . 74.41 111.4 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.516 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 36.9 mt-10 -70.42 -37.6 74.44 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 117.486 0.13 . . . . 75.54 111.31 178.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.582 ' HA ' HD13 ' A' ' 12' ' ' LEU . 5.9 m -74.81 -29.51 61.11 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 123.485 0.49 . . . . 64.32 111.369 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.466 ' O ' HG13 ' A' ' 14' ' ' ILE . 29.2 t-20 -70.92 -35.88 72.45 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.492 -0.322 . . . . 73.45 110.422 172.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.6 tp -65.95 -34.42 78.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.582 0.753 . . . . 72.2 110.882 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.767 ' HA ' HD12 ' A' ' 23' ' ' LEU . 95.6 mt -62.12 -39.99 94.38 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.514 -0.766 . . . . 73.14 110.831 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.3 t -70.41 -31.39 68.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.058 0.543 . . . . 74.13 112.27 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 10' ' ' ASN . 77.4 mt -68.77 -45.21 81.37 Favored 'Isoleucine or valine' 0 C--N 1.347 0.463 0 CA-C-O 120.908 0.385 . . . . 75.12 110.731 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -108.33 23.62 14.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.324 0.49 . . . . 75.23 112.324 -172.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 65.9 t30 -82.41 114.36 20.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.888 0.375 . . . . 72.32 110.221 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.32 -76.27 0.6 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.48 -0.782 . . . . 74.3 109.534 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.89 61.66 0.6 Allowed Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.961 -0.856 . . . . 75.43 110.961 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.6 -149.22 21.62 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.33 -0.462 . . . . 71.35 112.348 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.494 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -78.87 -15.26 58.57 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 111.789 0.292 . . . . 74.14 111.789 -176.489 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -46.35 70.73 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 109.153 -0.684 . . . . 63.52 109.153 172.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.68 -35.54 91.35 Favored Glycine 0 C--O 1.216 -0.98 0 O-C-N 124.025 0.828 . . . . 74.21 113.217 172.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.767 HD12 ' HA ' ' A' ' 12' ' ' LEU . 1.7 mm? -64.05 -46.62 83.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 117.117 0.458 . . . . 73.22 112.097 176.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 48.9 mtt -67.8 -42.43 81.62 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.952 0.352 . . . . 74.42 111.952 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -70.27 -44.05 69.23 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 112.319 0.488 . . . . 71.21 112.319 -178.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -74.56 -31.3 62.05 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.47 0.544 . . . . 74.25 112.47 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 45.3 mt -72.6 -46.71 53.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 119.16 -0.448 . . . . 75.34 110.911 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -68.15 -25.26 65.18 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.693 0.627 . . . . 72.5 112.693 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.07 -26.39 36.33 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 111.469 0.174 . . . . 74.14 111.469 177.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.3 5.48 39.97 Favored 'General case' 0 C--O 1.209 -1.04 0 N-CA-C 112.689 0.625 . . . . 74.3 112.689 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 64.5 mt -60.6 -33.38 14.41 Favored Pre-proline 0 CA--C 1.56 1.351 0 N-CA-C 114.498 1.296 . . . . 74.14 114.498 176.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 31' ' ' LEU . 17.0 Cg_endo -60.46 -22.82 73.13 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.142 1.894 . . . . 75.32 114.283 166.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -105.12 -140.15 0.37 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.057 0.943 . . . . 75.53 109.181 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 86.0 mtp 73.31 160.09 0.23 Allowed 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.834 1.654 . . . . 75.24 113.194 172.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.49 148.01 47.21 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.05 -1.093 . . . . 71.25 108.05 168.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -67.23 -28.14 67.81 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 118.661 0.664 . . . . 75.4 112.159 -178.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.35 -46.09 77.97 Favored 'General case' 0 C--O 1.215 -0.757 0 O-C-N 123.481 0.488 . . . . 54.14 110.671 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.6 mmt -75.28 -28.64 59.83 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 123.833 0.708 . . . . 74.3 112.549 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -75.01 -48.96 21.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.632 0.773 . . . . 73.5 111.503 -173.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.91 -28.18 62.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.326 -0.397 . . . . 75.12 111.8 177.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.1 tp -64.97 -38.89 92.46 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.899 -0.591 . . . . 72.3 110.551 171.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.94 -28.42 68.27 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.355 1.062 . . . . 74.43 112.655 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -60.17 -39.54 86.82 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 123.671 0.607 . . . . 72.2 110.735 173.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -79.78 -30.58 40.67 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.063 -0.517 . . . . 73.11 111.336 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.411 ' O ' HG12 ' A' ' 49' ' ' ILE . 73.2 m -70.45 -37.39 74.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.707 0.403 . . . . 72.34 111.189 -177.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.53 -31.9 63.92 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 111.406 0.15 . . . . 74.13 111.406 173.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.75 -31.54 71.53 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.666 0.604 . . . . 75.13 112.123 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.536 ' HZ3' HD22 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -87.31 -22.07 25.35 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.769 0.655 . . . . 75.21 112.769 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 45' ' ' THR . 35.6 pt -95.23 -12.29 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.389 0.541 . . . . 74.23 112.279 178.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.36 -44.13 87.11 Favored Pre-proline 0 CA--C 1.561 1.369 0 N-CA-C 113.828 1.047 . . . . 74.32 113.828 173.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -71.96 -10.97 26.94 Favored 'Trans proline' 0 C--N 1.38 2.207 0 CA-C-N 121.767 1.667 . . . . 61.22 113.868 170.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 86.4 mt -91.57 156.15 17.86 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.99 -0.374 . . . . 74.41 109.99 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p -92.43 -178.24 4.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.045 -0.525 . . . . 72.44 109.903 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.484 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -78.27 -25.01 46.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.35 -0.386 . . . . 74.53 111.018 175.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.87 -32.89 59.91 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 122.807 0.443 . . . . 75.31 111.799 173.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.62 -47.98 79.19 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.115 0.259 . . . . 71.43 110.641 173.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.85 -23.87 63.35 Favored 'General case' 0 C--O 1.21 -0.996 0 O-C-N 123.781 0.676 . . . . 74.35 111.931 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.8 -35.97 75.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.884 0.765 . . . . 71.12 111.616 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -82.68 -24.04 33.88 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.088 -0.506 . . . . 74.21 111.903 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.539 HD21 ' HA ' ' A' ' 1' ' ' MET . 57.1 mt -101.66 16.01 27.13 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.239 0.615 . . . . 74.03 112.263 -175.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -82.78 97.39 8.57 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.228 -0.442 . . . . 42.23 110.446 -176.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mp 58.19 78.81 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 125.157 1.536 . . . . 73.03 110.391 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -100.05 -23.43 14.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.832 -1.076 . . . . 74.24 111.107 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.53 ' H ' HG21 ' A' ' 9' ' ' THR . . . -148.05 80.86 1.48 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.104 0.478 . . . . 73.34 111.048 -177.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -150.94 13.15 0.69 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.01 -0.541 . . . . 75.13 111.22 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -104.14 -4.12 23.56 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.99 0.367 . . . . 74.34 111.99 -174.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -82.45 -7.75 59.63 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.956 -0.566 . . . . 60.44 110.99 177.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.9 m -102.09 10.38 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 116.396 -0.365 . . . . 65.32 111.184 175.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 71.9 mt -82.21 162.21 22.46 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.515 -0.311 . . . . 72.51 110.967 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 67.42 19.58 10.03 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.195 1.398 . . . . 72.11 111.834 -174.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -90.13 -7.21 54.28 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.626 -0.879 . . . . 75.52 108.626 167.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -138.89 171.15 14.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.256 -1.338 . . . . 72.14 108.198 172.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 -112.43 138.84 48.6 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.426 -0.583 . . . . 70.43 109.426 171.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 21.1 t-80 -90.35 135.91 33.39 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.486 -0.561 . . . . 75.23 109.486 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -111.58 179.37 4.04 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.866 -0.606 . . . . 75.1 110.053 -177.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 . . . . . 0 CA--C 1.536 0.405 0 CA-C-N 116.113 -0.494 . . . . 65.41 110.319 175.162 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.4 ttp . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 109.701 -0.481 . . . . 72.24 109.701 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.574 HG23 HD23 ' A' ' 52' ' ' LEU . 45.3 pt -88.23 166.21 1.93 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-O 120.829 0.347 . . . . 73.11 110.964 178.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.72 117.47 34.45 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.6 -0.519 . . . . 75.1 109.6 175.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.525 ' H ' ' HZ ' ' A' ' 63' ' ' PHE . 66.0 mt -114.23 154.4 27.98 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.916 -1.038 . . . . 73.41 109.159 173.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 34.0 p -84.73 -177.25 6.54 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.481 0.178 . . . . 71.44 111.481 -178.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.743 HD12 ' HB2' ' A' ' 64' ' ' ALA . 15.7 mm -64.26 -36.42 77.03 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.361 -0.382 . . . . 74.22 110.171 177.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -69.03 -46.35 68.15 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.742 0.417 . . . . 75.51 111.546 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.534 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 43.9 mt-10 -68.35 -43.64 77.02 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.982 0.801 . . . . 73.04 111.399 -175.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.483 ' HB ' ' O ' ' A' ' 64' ' ' ALA . 9.1 m -74.56 -29.68 61.44 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 122.659 0.384 . . . . 74.23 111.747 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -64.75 -42.56 95.08 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.6 0.36 . . . . 72.53 110.8 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.516 HD23 ' HA ' ' A' ' 42' ' ' ALA . 7.0 tp -61.83 -41.8 98.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.99 0.916 . . . . 64.43 111.606 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.798 HD21 HD21 ' A' ' 23' ' ' LEU . 65.9 mt -68.64 -31.25 70.25 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 116.204 -0.453 . . . . 74.05 111.296 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.6 t -70.53 -24.3 62.79 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.609 0.764 . . . . 72.31 111.751 176.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.0 mt -78.03 -42.4 27.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 122.53 0.332 . . . . 74.13 110.717 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -106.78 11.64 29.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.602 0.593 . . . . 63.44 112.602 -173.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -58.45 103.23 0.14 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.385 1.074 . . . . 73.24 111.761 175.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -101.6 -75.65 0.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.373 -0.83 . . . . 63.11 110.223 177.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.92 74.45 0.44 Allowed Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.416 -0.674 . . . . 71.42 111.416 -175.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.79 -136.84 19.12 Favored Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 110.874 -0.89 . . . . 71.11 110.874 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.88 -23.11 18.89 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 120.55 0.214 . . . . 75.45 110.857 173.275 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -74.42 -49.91 20.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.791 -0.641 . . . . 74.42 110.371 -176.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.04 -29.94 75.98 Favored Glycine 0 C--N 1.337 0.585 0 O-C-N 123.457 0.473 . . . . 74.31 112.434 172.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.798 HD21 HD21 ' A' ' 12' ' ' LEU . 63.6 tp -61.68 -43.49 98.76 Favored 'General case' 0 C--O 1.218 -0.596 0 C-N-CA 123.275 0.63 . . . . 74.35 110.949 174.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.412 ' HG2' HD13 ' A' ' 46' ' ' LEU . 55.8 mtt -70.08 -40.21 75.15 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.245 0.341 . . . . 73.41 111.81 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.75 -39.59 93.89 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.374 0.421 . . . . 74.5 111.64 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -72.86 -40.27 65.81 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 115.946 -0.57 . . . . 74.25 110.921 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.442 HG23 ' HE2' ' A' ' 34' ' ' MET . 32.6 mt -67.38 -46.33 83.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 119.155 -0.45 . . . . 74.21 112.192 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -67.35 -25.24 65.89 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.098 0.777 . . . . 75.42 113.098 -176.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.89 -35.42 24.13 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.476 0.176 . . . . 72.04 111.476 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.542 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.45 16.07 22.86 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 113.078 0.77 . . . . 73.33 113.078 -172.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.8 mt -53.44 -51.18 78.15 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 114.373 1.249 . . . . 74.3 114.373 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.53 -23.52 57.36 Favored 'Trans proline' 0 C--N 1.38 2.22 0 CA-C-N 121.834 1.691 . . . . 74.13 113.409 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.542 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 15.0 m-85 -92.7 10.84 28.95 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.109 0.563 . . . . 73.52 111.127 -173.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.442 ' HE2' HG23 ' A' ' 27' ' ' ILE . 62.8 mtt -99.17 16.29 23.28 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.009 -0.541 . . . . 73.4 111.823 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.29 -77.05 0.06 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.956 1.302 . . . . 73.52 111.976 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.65 -53.91 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.199 0.6 . . . . 74.22 109.728 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -70.48 -36.07 73.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 123.682 0.614 . . . . 71.11 112.049 -172.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 16.2 mmt -74.36 -29.57 61.62 Favored 'General case' 0 C--O 1.213 -0.82 0 O-C-N 123.363 0.415 . . . . 74.54 111.461 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -70.9 -52.5 19.7 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.45 0.3 . . . . 74.42 111.584 -177.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -66.64 -36.21 82.01 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.818 -0.628 . . . . 75.41 111.395 -176.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.427 HD13 ' HG2' ' A' ' 8' ' ' GLU . 27.7 tp -70.57 -34.81 72.62 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.8 -0.636 . . . . 75.24 111.02 177.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.516 ' HA ' HD23 ' A' ' 11' ' ' LEU . . . -66.96 -37.78 84.89 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 112.611 0.597 . . . . 61.44 112.611 -177.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -73.17 -33.59 65.52 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.004 0.19 . . . . 74.22 111.43 178.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -67.58 -43.11 81.36 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.518 0.511 . . . . 72.43 111.324 174.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.462 ' O ' HG13 ' A' ' 49' ' ' ILE . 21.8 m -76.53 -30.59 57.19 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.173 -0.467 . . . . 73.14 111.274 -177.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.412 HD13 ' HG2' ' A' ' 24' ' ' MET . 12.7 mt -69.98 -30.1 67.36 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 118.724 0.693 . . . . 72.34 112.035 175.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.54 -19.31 60.94 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.362 0.414 . . . . 72.14 111.291 173.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -88.76 -24.31 22.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.009 0.523 . . . . 74.33 111.365 177.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.496 HG23 HD13 ' A' ' 52' ' ' LEU . 15.4 mt -94.09 -8.53 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.322 0.582 . . . . 75.24 109.771 175.191 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.8 -41.48 77.49 Favored Pre-proline 0 CA--C 1.557 1.243 0 CA-C-O 118.026 -0.988 . . . . 71.23 113.509 174.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.47 1.71 8.5 Favored 'Trans proline' 0 C--N 1.381 2.278 0 CA-C-N 121.677 1.635 . . . . 75.23 114.124 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.574 HD23 HG23 ' A' ' 2' ' ' ILE . 54.0 mt -96.73 169.31 9.96 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.976 -0.379 . . . . 75.35 109.976 176.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 16.9 p -105.67 -170.64 1.77 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.013 -0.54 . . . . 72.41 109.798 168.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -23.35 44.74 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.767 -0.457 . . . . 73.4 109.767 171.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -66.23 -46.3 77.68 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.798 0.839 . . . . 73.41 109.52 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.428 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 17.6 mm-40 -67.18 -29.54 69.25 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.883 0.74 . . . . 75.51 112.986 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.443 ' HH ' HD23 ' A' ' 23' ' ' LEU . 66.9 t80 -74.73 -36.7 62.65 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 110.43 -0.211 . . . . 75.5 110.43 176.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.64 -14.98 60.39 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.156 0.428 . . . . 62.14 112.156 177.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.51 -42.96 82.0 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 122.191 0.196 . . . . 74.41 111.309 172.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.521 ' HB2' ' CD1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -86.45 -44.96 11.59 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 120.939 -0.304 . . . . 73.21 111.36 178.111 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.3 34.41 22.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.292 1.437 . . . . 65.1 114.44 166.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.3 mm 67.02 93.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 122.452 1.12 . . . . 73.12 109.904 -173.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.525 ' HZ ' ' H ' ' A' ' 4' ' ' LEU . 21.6 p90 -117.35 -2.58 11.55 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.084 -1.417 . . . . 73.15 111.592 -171.187 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.743 ' HB2' HD12 ' A' ' 6' ' ' ILE . . . -153.82 75.31 1.03 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.09 0.471 . . . . 71.31 111.527 -173.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -142.58 -0.15 1.24 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.397 -0.365 . . . . 73.54 111.068 177.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -80.86 -30.88 35.57 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.835 -0.621 . . . . 74.54 111.84 -171.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -82.41 -14.87 54.47 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.955 0.724 . . . . 72.43 112.955 -166.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.9 m -95.3 -3.24 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 111.749 0.277 . . . . 74.35 111.749 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 78.0 mt -114.8 -66.51 1.08 Allowed 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.253 -0.647 . . . . 74.23 109.253 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.654 ' HG2' ' H ' ' A' ' 75' ' ' HIS . 17.6 mt-10 -85.49 100.86 12.18 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 124.096 0.872 . . . . 74.34 108.718 178.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -116.51 -0.42 12.47 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.96 0.409 . . . . 74.51 111.559 -173.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -132.95 -59.16 0.9 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.921 -0.4 . . . . 64.23 109.921 177.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -133.18 -77.69 0.48 Allowed 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.899 -0.778 . . . . 62.15 108.899 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.1 m80 -140.05 143.65 36.47 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 109.416 -0.587 . . . . 74.5 109.416 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.654 ' H ' ' HG2' ' A' ' 70' ' ' GLU . 18.0 m170 65.11 177.56 0.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 125.129 1.372 . . . . 65.21 113.893 177.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.486 -0.779 . . . . 73.53 109.33 172.742 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ttt . . . . . 0 N--CA 1.476 0.846 0 N-CA-C 110.037 -0.357 . . . . 75.11 110.037 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.1 tt -83.01 120.29 34.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 108.488 -0.93 . . . . 74.31 108.488 169.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.425 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 10.2 tpt180 -90.03 111.47 22.58 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.308 -0.997 . . . . 74.41 108.308 -178.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.745 HD12 ' HZ1' ' A' ' 48' ' ' LYS . 58.3 mt -81.49 142.55 32.8 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-N 114.898 -1.046 . . . . 75.52 110.623 -171.35 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.409 HG22 ' HG3' ' A' ' 8' ' ' GLU . 11.5 t -82.0 166.33 19.91 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.436 -0.802 . . . . 74.44 109.448 -174.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.509 HG22 HG11 ' A' ' 68' ' ' VAL . 21.9 mm -59.7 -33.06 50.85 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 O-C-N 123.663 0.602 . . . . 74.31 110.951 -177.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -70.6 -38.91 74.05 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.416 0.895 . . . . 73.31 113.416 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.417 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 48.4 mt-10 -68.17 -41.06 82.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.08 0.467 . . . . 72.51 110.889 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.626 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.7 m -74.61 -29.07 61.17 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.127 -0.942 . . . . 53.21 111.468 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -65.45 -38.81 90.95 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.399 0.68 . . . . 73.43 110.688 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.499 HD22 ' HA ' ' A' ' 42' ' ' ALA . 59.9 tp -65.34 -33.67 76.51 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.897 -0.592 . . . . 74.15 110.939 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 77.9 mt -66.07 -36.84 84.29 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.899 -0.591 . . . . 62.23 110.801 173.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 m -65.07 -23.63 67.22 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.288 0.477 . . . . 61.15 112.288 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.9 mt -85.19 -39.83 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 111.677 0.251 . . . . 65.24 111.677 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -120.24 0.81 10.72 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.804 1.409 . . . . 75.12 114.804 -166.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.465 ' HB2' HD21 ' A' ' 23' ' ' LEU . 4.3 t30 -86.65 121.78 29.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.448 0.567 . . . . 72.23 110.15 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.28 -14.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.843 -0.343 . . . . 71.44 111.873 173.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.56 61.9 0.32 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.483 -0.865 . . . . 61.34 113.573 -173.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.59 -161.53 51.49 Favored Glycine 0 C--O 1.225 -0.458 0 C-N-CA 121.442 -0.409 . . . . 63.25 113.372 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.898 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 54.5 tttt -75.06 -37.15 61.72 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 123.666 0.274 . . . . 75.41 111.432 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -65.23 -48.65 72.58 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-O 118.976 -0.535 . . . . 75.2 110.964 177.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.37 -35.92 91.72 Favored Glycine 0 C--O 1.222 -0.627 0 O-C-N 123.654 0.596 . . . . 53.33 112.858 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 16' ' ' ASN . 2.4 tm? -62.02 -50.67 71.11 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.443 0.697 . . . . 73.22 110.591 176.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.878 ' HG2' HD22 ' A' ' 46' ' ' LEU . 40.7 mtt -71.66 -40.49 69.63 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 112.615 0.598 . . . . 73.52 112.615 -175.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.97 -35.43 78.36 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.294 0.372 . . . . 70.52 111.255 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -66.6 -48.61 68.97 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 123.358 0.411 . . . . 72.22 109.957 175.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.485 HG21 ' HE1' ' A' ' 34' ' ' MET . 11.8 mt -61.88 -43.58 97.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 123.732 0.645 . . . . 73.43 112.255 -179.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -64.67 -36.46 84.34 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.467 0.543 . . . . 75.33 112.467 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.11 -27.47 54.05 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.547 -0.297 . . . . 62.15 111.696 178.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.529 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -102.8 15.02 30.52 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 112.864 0.69 . . . . 74.12 112.864 -175.233 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 79.2 mt -58.05 -47.47 98.81 Favored Pre-proline 0 CA--C 1.556 1.176 0 N-CA-C 113.681 0.993 . . . . 74.4 113.681 178.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -83.19 10.41 3.67 Favored 'Trans proline' 0 C--N 1.378 2.122 0 C-N-CA 121.849 1.699 . . . . 73.52 113.603 173.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.433 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 98.2 m-85 -109.81 -3.62 16.56 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.045 0.538 . . . . 74.42 110.217 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.529 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.1 mtt -91.7 174.39 7.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.514 -0.766 . . . . 71.05 110.877 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.66 166.55 23.38 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.99 -0.744 . . . . 72.22 108.99 163.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -73.8 -30.47 62.75 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.787 -0.571 . . . . 74.23 110.919 -178.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -72.26 -33.86 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.212 -0.449 . . . . 71.52 110.718 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.3 ttm -75.0 -27.5 60.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.724 -0.671 . . . . 71.55 110.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -75.7 -43.1 48.9 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.516 0.726 . . . . 74.11 111.923 -177.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -72.13 -29.02 63.65 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.658 -0.246 . . . . 73.33 110.994 174.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.96 -30.98 68.47 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 116.148 -0.478 . . . . 75.13 110.278 174.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.527 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -62.78 -43.32 99.11 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 123.004 0.522 . . . . 75.22 111.75 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -69.41 -33.9 73.67 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.365 0.416 . . . . 73.34 111.578 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -65.3 -42.94 92.54 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.347 -0.842 . . . . 65.05 110.727 176.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.783 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 90.6 m -74.24 -36.32 63.89 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.973 -1.012 . . . . 73.32 111.665 -178.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.878 HD22 ' HG2' ' A' ' 24' ' ' MET . 49.4 mt -69.43 -31.1 69.22 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.814 -0.553 . . . . 64.34 112.384 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.64 91.81 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.668 0.618 . . . . 65.43 112.668 -177.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.783 ' HE3' ' HA ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -88.93 -7.71 55.54 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.197 0.814 . . . . 74.45 113.197 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.46 HG23 ' HG3' ' A' ' 20' ' ' LYS . 49.8 mt -97.53 -20.83 5.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.964 0.412 . . . . 70.33 109.901 174.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -50.28 -43.69 79.09 Favored Pre-proline 0 CA--C 1.559 1.301 0 N-CA-C 115.64 1.718 . . . . 74.25 115.64 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -80.15 8.64 3.99 Favored 'Trans proline' 0 C--N 1.385 2.458 0 CA-C-N 122.289 1.853 . . . . 74.11 114.474 178.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 40.1 mt -100.48 145.73 27.92 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 110.172 -0.307 . . . . 73.11 110.172 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.5 t -98.15 29.01 3.7 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-O 121.502 0.667 . . . . 73.44 110.852 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.898 ' HG2' ' HB3' ' A' ' 20' ' ' LYS . 47.3 mt-10 83.35 -28.66 0.1 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 126.706 2.002 . . . . 72.35 112.85 172.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -72.4 -33.58 67.27 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.028 0.442 . . . . 74.41 110.931 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -76.97 -29.15 55.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.472 -0.785 . . . . 75.45 110.485 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -71.91 -29.64 64.54 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.402 -0.363 . . . . 74.4 110.848 173.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.47 80.68 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.973 0.416 . . . . 73.31 110.968 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.63 -32.2 65.72 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.921 -1.036 . . . . 65.33 111.117 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.4 mt -86.5 -82.24 0.21 Allowed 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.074 -0.343 . . . . 72.22 110.074 176.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.34 -131.06 2.14 Favored 'General case' 0 C--N 1.35 0.626 0 C-N-CA 125.224 1.41 . . . . 74.14 111.537 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.4 mp -92.66 88.19 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.495 -0.928 . . . . 75.13 108.495 178.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.513 ' HE1' HD13 ' A' ' 4' ' ' LEU . 19.0 p90 -110.04 -32.54 6.98 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.454 -0.794 . . . . 75.45 111.36 -178.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.626 ' H ' HG21 ' A' ' 9' ' ' THR . . . -133.81 64.96 1.59 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.63 0.729 . . . . 72.32 111.235 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -132.17 20.3 4.45 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.779 0.799 . . . . 73.41 110.259 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -95.69 12.99 27.9 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.567 -0.742 . . . . 74.05 111.294 -176.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -111.35 9.74 21.56 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.969 -0.559 . . . . 75.23 111.826 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.509 HG11 HG22 ' A' ' 6' ' ' ILE . 28.5 m -108.82 11.88 8.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 120.565 0.222 . . . . 73.44 111.188 177.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.1 mp -83.37 85.05 7.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.208 -0.451 . . . . 74.33 110.494 -175.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 54.42 50.77 15.46 Favored 'General case' 0 C--N 1.346 0.431 0 O-C-N 125.039 1.462 . . . . 73.12 111.078 -175.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -74.98 -41.52 59.39 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 114.72 -1.127 . . . . 71.52 109.41 -178.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 46.3 t60 -143.49 114.62 7.85 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.044 -1.095 . . . . 73.31 108.044 169.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -147.92 146.82 29.17 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.835 -0.621 . . . . 74.35 110.528 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -140.66 -60.62 0.51 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.514 -0.551 . . . . 75.24 109.514 174.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 57.2 t60 60.47 91.87 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 125.006 1.441 . . . . 72.42 110.966 -173.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 27.7 p80 . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 115.339 -0.846 . . . . 73.3 111.332 -179.74 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 120.918 0.39 . . . . 74.23 110.118 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.797 HD13 ' HB3' ' A' ' 48' ' ' LYS . 15.1 tt -86.35 150.85 3.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.48 -0.782 . . . . 74.22 109.98 178.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.95 98.15 7.51 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.465 1.126 . . . . 74.51 109.862 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.9 mt -106.23 152.67 23.2 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.605 -1.18 . . . . 65.21 109.508 174.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.1 p -81.47 163.63 22.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.347 -0.541 . . . . 71.23 109.775 173.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.505 HG23 ' HB1' ' A' ' 64' ' ' ALA . 31.0 mm -67.62 -29.17 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 116.006 -0.543 . . . . 70.23 111.135 -174.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -70.86 -37.43 73.1 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.966 -0.561 . . . . 73.45 110.974 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.604 0.594 . . . . 71.15 112.604 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.739 ' HB ' ' HB2' ' A' ' 64' ' ' ALA . 3.4 m -74.88 -29.32 60.97 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.738 0.304 . . . . 74.34 110.647 178.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.446 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.5 t-20 -67.61 -38.89 84.61 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.096 -0.335 . . . . 74.55 110.096 171.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.752 HD21 ' HA ' ' A' ' 42' ' ' ALA . 19.1 tp -60.71 -38.54 85.41 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.984 0.913 . . . . 74.55 111.64 175.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 89.5 mt -66.77 -32.72 74.19 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.836 -0.62 . . . . 74.51 111.423 174.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 t -72.0 -29.04 63.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.243 0.617 . . . . 75.53 112.081 177.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.662 HD13 ' HA ' ' A' ' 11' ' ' LEU . 71.8 mt -66.44 -42.69 90.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.119 0.568 . . . . 75.4 110.051 178.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.529 ' HH ' ' HG3' ' A' ' 34' ' ' MET . 75.9 m-85 -111.03 35.28 3.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.809 -0.632 . . . . 74.53 110.91 -175.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -83.31 103.7 12.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.482 0.658 . . . . 64.01 111.815 -172.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.473 ' HG2' HD21 ' A' ' 26' ' ' ASN . 4.7 pt-20 -142.3 122.2 13.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.793 -1.094 . . . . 64.44 110.122 171.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.04 -96.65 2.0 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.66 -0.7 . . . . 73.23 111.762 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.25 -131.28 1.2 Allowed Glycine 0 C--O 1.216 -0.973 0 N-CA-C 110.667 -0.973 . . . . 55.11 110.667 178.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -64.46 -46.18 84.19 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.63 0.772 . . . . 74.11 111.034 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -71.03 -47.89 56.09 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 123.372 0.42 . . . . 74.15 111.047 -175.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.65 -29.58 75.45 Favored Glycine 0 C--N 1.336 0.53 0 O-C-N 123.868 0.73 . . . . 72.22 113.531 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -43.83 98.25 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.468 0.307 . . . . 73.52 111.097 171.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.814 ' HG2' HD23 ' A' ' 46' ' ' LEU . 49.2 mtt -68.72 -38.63 80.36 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.335 0.397 . . . . 74.4 111.004 177.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.06 -44.99 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.171 0.434 . . . . 73.43 112.171 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.473 HD21 ' HG2' ' A' ' 17' ' ' GLU . 28.2 t-20 -69.48 -43.47 73.12 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.584 0.553 . . . . 63.11 110.576 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.466 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 30.9 mt -63.78 -48.19 87.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 119.12 -0.467 . . . . 71.24 111.972 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.7 -30.47 67.05 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.695 0.628 . . . . 74.41 112.695 -176.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.93 -33.72 66.12 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.033 0.208 . . . . 74.11 111.011 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.591 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -95.84 7.57 45.95 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.792 0.664 . . . . 51.24 112.792 -176.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 49.3 mt -60.93 -44.7 95.59 Favored Pre-proline 0 N--CA 1.481 1.119 0 N-CA-C 113.954 1.094 . . . . 64.33 113.954 178.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -65.35 -19.59 61.7 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.023 1.815 . . . . 74.21 114.312 174.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.591 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 20.2 m-85 -96.94 -10.49 26.25 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.713 0.292 . . . . 75.15 110.395 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.529 ' HG3' ' HH ' ' A' ' 15' ' ' TYR . 25.3 ttm -86.35 143.23 27.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 72.01 110.718 -171.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.42 145.56 51.29 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.851 0.719 . . . . 74.42 109.413 172.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -60.06 -30.58 69.3 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.887 1.069 . . . . 74.34 113.887 -173.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -70.06 -44.61 68.81 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.02 0.438 . . . . 64.31 110.704 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.1 ttm -74.5 -29.65 61.5 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.133 -0.939 . . . . 72.2 111.292 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.4 ttt180 -69.26 -44.89 70.99 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.736 0.814 . . . . 73.45 111.729 -178.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.53 -33.2 70.91 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 116.305 -0.407 . . . . 74.33 111.176 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.2 tp -67.91 -40.09 83.46 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.862 -0.608 . . . . 72.44 110.431 175.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.752 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -60.92 -45.08 96.07 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.91 0.884 . . . . 72.12 113.125 -176.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -66.48 -30.16 70.44 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.469 0.481 . . . . 72.23 112.094 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 -76.6 -33.48 58.43 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 123.128 0.267 . . . . 73.13 111.532 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.3 m -71.37 -31.3 67.15 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.569 0.348 . . . . 71.01 110.505 174.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.814 HD23 ' HG2' ' A' ' 24' ' ' MET . 63.1 mt -68.61 -30.27 68.97 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 122.642 0.377 . . . . 74.44 111.379 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.12 61.35 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 123.21 0.319 . . . . 71.34 111.639 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.797 ' HB3' HD13 ' A' ' 2' ' ' ILE . 5.8 mttt -84.43 -37.16 21.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.701 0.401 . . . . 62.11 111.8 175.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.78 -9.31 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 112.7 0.63 . . . . 61.12 112.7 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.4 -48.96 96.42 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.911 -1.042 . . . . 75.11 113.54 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.63 -4.81 15.42 Favored 'Trans proline' 0 C--N 1.385 2.468 0 CA-C-N 121.646 1.623 . . . . 73.24 113.977 176.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.54 HD13 HD12 ' A' ' 2' ' ' ILE . 43.6 mt -89.26 145.95 25.06 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.654 -0.499 . . . . 73.14 109.654 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.44 HG23 ' H ' ' A' ' 56' ' ' GLU . 11.5 t -83.62 163.24 20.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.741 -0.663 . . . . 72.22 109.805 172.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -61.53 -39.65 91.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.019 0.928 . . . . 73.21 111.477 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.9 -35.49 76.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.834 -0.621 . . . . 74.05 112.323 -176.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.44 ' H ' HG23 ' A' ' 53' ' ' THR . 39.2 tt0 -75.87 -33.54 59.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 123.248 0.342 . . . . 72.43 111.033 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -69.89 -30.64 68.13 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.026 0.204 . . . . 75.02 111.034 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.43 -24.2 63.8 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.044 0.387 . . . . 74.5 112.044 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -76.0 -27.29 57.35 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.251 -0.431 . . . . 72.53 111.294 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.48 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.8 mt -81.53 -55.32 4.75 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.922 -0.581 . . . . 71.24 110.757 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.88 -110.3 0.55 Allowed 'General case' 0 C--N 1.348 0.503 0 O-C-N 125.114 1.509 . . . . 73.15 110.183 -168.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.4 HG23 HG23 ' A' ' 9' ' ' THR . 48.3 mm -121.47 105.43 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.111 -0.7 . . . . 72.14 109.111 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.48 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 2.7 m-85 -97.48 24.16 6.9 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.026 -0.534 . . . . 73.23 111.813 178.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.739 ' HB2' ' HB ' ' A' ' 9' ' ' THR . . . -148.96 -149.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.315 -0.402 . . . . 70.04 110.114 -177.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 72.34 12.84 5.66 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.348 1.459 . . . . 64.33 112.435 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.406 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 32.3 t70 -101.5 -32.15 10.54 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 121.123 0.487 . . . . 74.23 110.479 -179.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -81.99 -13.13 57.85 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.403 -0.362 . . . . 75.42 111.776 176.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.9 m -112.27 35.54 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 116.425 -0.352 . . . . 62.45 111.756 -177.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 66' ' ' ASP . 96.0 mt -66.72 -44.49 81.46 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.319 -0.4 . . . . 71.34 111.235 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -92.31 -63.96 1.17 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.775 -0.648 . . . . 70.35 110.931 -175.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 2.2 t60 61.2 35.55 18.34 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.96 1.304 . . . . 73.32 108.901 -167.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 58.2 m80 62.83 -161.02 0.3 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.46 1.104 . . . . 74.53 110.883 -172.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -93.31 11.5 27.93 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.155 0.798 . . . . 74.43 113.155 -172.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -155.65 154.11 31.07 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.692 -0.484 . . . . 74.42 109.692 176.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.5 m80 72.34 113.47 0.06 Allowed 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 125.345 1.458 . . . . 75.05 112.323 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 . . . . . 0 N--CA 1.476 0.831 0 C-N-CA 124.51 1.124 . . . . 75.04 110.916 178.389 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.572 ' HG3' HD22 ' A' ' 60' ' ' LEU . 12.3 tmm? . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 109.648 -0.501 . . . . 74.23 109.648 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.747 HD12 ' HB3' ' A' ' 48' ' ' LYS . 93.3 mt 75.61 -45.84 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 125.148 1.379 . . . . 73.51 114.185 172.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 85.11 80.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 127.426 2.29 . . . . 72.42 108.595 -171.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.488 HD21 ' HG2' ' A' ' 8' ' ' GLU . 76.6 mt -121.56 166.9 13.52 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 113.511 -1.677 . . . . 74.54 108.395 175.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 15.3 t -98.67 173.52 6.86 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 109.244 -0.65 . . . . 71.25 109.244 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.548 HG21 ' HB2' ' A' ' 67' ' ' GLU . 10.7 mm -60.32 -24.94 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.953 1.301 . . . . 74.44 112.192 -175.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.89 -37.79 70.09 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.724 0.809 . . . . 72.22 112.564 -178.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.488 ' HG2' HD21 ' A' ' 4' ' ' LEU . 1.3 mp0 -63.74 -43.96 94.94 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.174 0.512 . . . . 72.32 110.943 178.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.419 ' HA ' ' HG ' ' A' ' 12' ' ' LEU . 6.7 p -74.96 -25.36 58.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.659 -1.155 . . . . 64.34 112.666 178.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.468 ' O ' HG13 ' A' ' 14' ' ' ILE . 4.0 t-20 -66.52 -33.51 75.83 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.916 0.486 . . . . 64.13 111.151 174.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.414 ' HA ' HD13 ' A' ' 14' ' ' ILE . 58.7 tp -62.91 -33.96 76.42 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 122.816 0.446 . . . . 74.21 110.891 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.81 HD21 HD21 ' A' ' 23' ' ' LEU . 13.8 mt -71.46 -38.61 71.27 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.517 -0.765 . . . . 72.01 110.433 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.6 p -72.04 -22.19 61.42 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.785 0.661 . . . . 74.04 112.785 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 10' ' ' ASN . 99.3 mt -60.88 -47.42 93.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.78 0.324 . . . . 73.31 110.218 174.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -91.91 -78.09 0.41 Allowed 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.22 -0.445 . . . . 72.24 110.947 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.6 t30 52.96 71.34 0.49 Allowed 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.727 1.267 . . . . 73.33 110.094 -172.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -140.31 123.25 16.53 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.495 -1.229 . . . . 73.3 109.818 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.34 21.24 79.46 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 115.272 0.869 . . . . 75.11 115.272 168.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.71 -140.49 29.17 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 121.294 -0.479 . . . . 72.32 112.595 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.787 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -76.8 -33.68 57.98 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 123.745 0.32 . . . . 64.32 111.307 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 38.6 mtt180 -65.28 -61.42 2.13 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 119.427 -0.321 . . . . 71.41 110.96 177.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.28 -30.82 78.71 Favored Glycine 0 C--O 1.214 -1.111 0 O-C-N 124.56 1.163 . . . . 42.33 113.924 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.81 HD21 HD21 ' A' ' 12' ' ' LEU . 26.3 tp -65.18 -48.86 71.96 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 117.317 0.558 . . . . 73.24 110.632 177.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.0 mtp -69.95 -36.79 75.55 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 123.423 0.452 . . . . 74.41 111.435 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 62.4 mm-40 -68.74 -39.86 80.12 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.269 0.355 . . . . 74.51 111.779 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -69.59 -42.77 74.0 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 119.382 -0.342 . . . . 73.33 111.397 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.633 HG22 ' HE2' ' A' ' 34' ' ' MET . 40.3 mt -62.88 -43.73 99.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 O-C-N 123.784 0.677 . . . . 75.24 112.051 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.25 -39.79 95.61 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.06 0.763 . . . . 74.33 113.06 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.71 29.67 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.83 0.678 . . . . 71.52 112.83 -177.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.653 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -114.47 19.39 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.14 0.793 . . . . 63.34 113.14 -171.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 39.3 mt -51.0 -52.58 56.81 Favored Pre-proline 0 CA--C 1.552 1.049 0 N-CA-C 114.117 1.154 . . . . 72.3 114.117 174.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.48 -15.1 41.3 Favored 'Trans proline' 0 C--N 1.382 2.327 0 C-N-CA 121.777 1.651 . . . . 75.12 114.101 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.653 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 55.6 m-85 -96.58 -1.27 47.32 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.278 0.231 . . . . 74.32 111.452 -175.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.633 ' HE2' HG22 ' A' ' 27' ' ' ILE . 66.6 mtt -78.19 -77.82 0.15 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.941 0.4 . . . . 73.32 111.548 178.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -162.88 -90.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.107 -0.951 . . . . 62.22 109.136 -167.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 176.18 -51.92 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.765 1.226 . . . . 74.24 108.218 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -73.69 -38.08 64.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.248 -0.887 . . . . 63.11 109.366 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' MET . . . . . 0.465 ' HE1' HD11 ' A' ' 14' ' ' ILE . 0.1 OUTLIER -62.47 -25.69 68.13 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.628 -1.169 . . . . 73.13 113.237 178.096 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -62.56 -52.6 62.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.138 0.575 . . . . 75.04 111.202 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -68.88 -36.19 77.78 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.441 0.696 . . . . 73.3 111.551 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 8' ' ' GLU . 61.4 tp -59.64 -38.08 80.42 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.581 1.153 . . . . 73.33 111.807 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.29 82.66 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 124.121 0.888 . . . . 73.34 113.273 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -60.34 -40.82 92.04 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.704 0.628 . . . . 75.31 111.856 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 44' ' ' ARG . 48.0 mtm105 -76.2 -35.18 59.19 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.631 0.604 . . . . 75.44 112.631 -178.597 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.436 HG23 HD22 ' A' ' 12' ' ' LEU . 1.7 m -79.11 -38.6 35.78 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.597 0.221 . . . . 74.21 111.597 -176.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -66.6 -31.09 71.57 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.273 0.472 . . . . 72.53 112.273 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.81 -23.71 64.3 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.638 0.586 . . . . 74.33 111.555 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.747 ' HB3' HD12 ' A' ' 2' ' ' ILE . 73.9 mmtt -88.56 -28.3 20.82 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.256 -0.429 . . . . 75.04 112.033 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.421 ' HA ' HD11 ' A' ' 52' ' ' LEU . 35.6 mt -93.01 -21.11 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 110.703 -0.11 . . . . 71.33 110.703 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.43 -47.58 95.75 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 114.687 1.365 . . . . 72.51 114.687 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.16 5.64 6.11 Favored 'Trans proline' 0 C--N 1.383 2.346 0 CA-C-N 121.902 1.715 . . . . 72.32 114.385 176.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 49' ' ' ILE . 96.1 mt -98.75 168.19 10.3 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.502 -0.555 . . . . 74.33 109.502 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.434 ' OG1' ' HG2' ' A' ' 56' ' ' GLU . 63.5 p -102.96 -179.81 4.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.753 -0.462 . . . . 74.41 109.753 173.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.787 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -75.11 -22.71 58.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.858 -0.61 . . . . 63.52 110.721 174.336 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -74.39 -35.77 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.442 -0.799 . . . . 75.15 110.489 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.434 ' HG2' ' OG1' ' A' ' 53' ' ' THR . 21.5 mm-40 -70.9 -39.22 72.88 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.242 -0.436 . . . . 63.13 110.876 176.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -70.05 -28.21 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.173 -0.467 . . . . 74.04 111.045 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.19 -28.55 68.19 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 111.836 0.31 . . . . 74.32 111.836 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.43 -30.23 64.42 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.459 0.303 . . . . 73.31 111.792 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.572 HD22 ' HG3' ' A' ' 1' ' ' MET . 17.6 mt -79.01 -54.39 6.07 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.749 -0.463 . . . . 75.24 109.749 -178.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 52.21 42.93 31.0 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 125.214 1.571 . . . . 75.24 112.975 174.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.432 HG13 ' HB2' ' A' ' 12' ' ' LEU . 3.2 mp 68.98 112.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.981 0.912 . . . . 75.34 109.368 -168.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.68 -31.43 19.74 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.339 -0.846 . . . . 74.52 111.298 -171.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.4 ' HB3' HG22 ' A' ' 6' ' ' ILE . . . -154.42 128.26 8.78 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.024 0.44 . . . . 74.03 111.459 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -155.59 170.17 22.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.844 -0.616 . . . . 73.41 110.231 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.422 ' HA ' ' HG ' ' A' ' 69' ' ' LEU . 0.9 OUTLIER 75.82 -26.33 0.19 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 125.155 1.382 . . . . 75.1 113.401 177.557 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.548 ' HB2' HG21 ' A' ' 6' ' ' ILE . 7.6 mm-40 -76.02 -14.11 60.22 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.897 0.879 . . . . 74.03 111.372 -178.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 m -123.27 15.08 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 116.232 -0.44 . . . . 74.43 111.954 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.422 ' HG ' ' HA ' ' A' ' 66' ' ' ASP . 30.2 mt -77.73 146.77 35.73 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.671 0.249 . . . . 73.22 111.671 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.404 ' HG2' ' HA ' ' A' ' 76' ' ' HIS . 16.8 mt-10 56.88 34.49 24.88 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.357 1.063 . . . . 72.23 112.472 176.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 2.3 m80 -87.99 -171.14 3.27 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 115.931 -0.577 . . . . 75.1 110.456 177.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -82.15 85.08 6.85 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.956 0.884 . . . . 74.33 113.004 -170.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -168.89 -58.81 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 113.141 -1.845 . . . . 74.31 106.236 170.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -135.62 154.66 51.25 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.099 -0.501 . . . . 74.24 110.551 177.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -89.52 146.58 24.51 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 107.944 -1.132 . . . . 74.35 107.944 173.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.404 ' HA ' ' HG2' ' A' ' 70' ' ' GLU . 91.6 m-70 . . . . . 0 N--CA 1.481 1.103 0 O-C-N 124.549 1.156 . . . . 62.33 111.706 -174.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ptp . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.766 0.317 . . . . 73.41 110.648 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.571 HG22 ' HG3' ' A' ' 48' ' ' LYS . 12.5 tt -72.75 142.51 15.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 115.653 -0.703 . . . . 74.35 109.547 171.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -74.98 110.42 9.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.653 -0.869 . . . . 73.32 108.653 176.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.58 HD11 ' HD2' ' A' ' 48' ' ' LYS . 90.4 mt -116.43 157.27 25.4 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.514 -0.767 . . . . 62.41 110.935 178.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.459 HG23 ' HG2' ' A' ' 8' ' ' GLU . 8.2 t -90.27 169.66 10.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 115.475 -0.784 . . . . 61.05 108.889 167.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.697 HG23 ' HB2' ' A' ' 67' ' ' GLU . 17.1 mm -63.38 -32.02 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.414 0.686 . . . . 74.41 112.203 -176.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -71.52 -24.28 61.93 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.57 0.581 . . . . 73.3 112.57 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.48 ' HB3' HG23 ' A' ' 45' ' ' THR . 32.5 mm-40 -63.82 -52.53 59.75 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.492 0.663 . . . . 74.12 110.307 176.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -26.4 61.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.648 -1.16 . . . . 75.41 112.25 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.492 ' HB2' HG21 ' A' ' 68' ' ' VAL . 12.4 t30 -66.92 -39.59 87.4 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.733 0.413 . . . . 75.2 111.152 172.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.639 HD22 ' HA ' ' A' ' 42' ' ' ALA . 27.6 tp -69.43 -37.12 77.27 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.296 0.638 . . . . 72.22 111.153 175.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.7 mt -66.11 -32.06 73.3 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.932 -0.576 . . . . 75.33 111.743 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.1 t -65.75 -32.58 74.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.798 0.687 . . . . 64.01 111.292 177.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 62.6 mt -67.08 -36.66 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 123.3 0.64 . . . . 62.13 110.854 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -116.59 28.5 8.52 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 71.5 112.303 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -83.44 95.76 8.35 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.41 -0.359 . . . . 74.3 110.948 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -166.4 136.06 3.17 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.932 -0.576 . . . . 70.21 110.007 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.38 23.68 60.34 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 115.316 0.886 . . . . 74.42 115.316 169.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 -144.5 31.33 Favored Glycine 0 C--O 1.222 -0.631 0 CA-C-N 117.216 0.508 . . . . 63.22 112.331 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -79.25 -36.92 39.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.523 0.329 . . . . 75.45 110.702 176.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -64.8 -47.84 76.61 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.321 -0.399 . . . . 75.31 110.903 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.68 -35.56 90.01 Favored Glycine 0 C--O 1.219 -0.822 0 CA-C-O 119.326 -0.708 . . . . 61.33 112.773 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.91 -47.19 83.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.939 0.495 . . . . 71.13 111.172 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.441 ' HG2' HD23 ' A' ' 46' ' ' LEU . 42.9 mtt -68.98 -35.59 76.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.792 -0.64 . . . . 71.12 112.133 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -72.57 -33.56 66.87 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.01 0.374 . . . . 74.34 112.01 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -71.03 -37.63 72.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.658 0.383 . . . . 71.41 111.383 176.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.29 -41.95 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 116.211 -0.45 . . . . 71.42 111.349 178.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -70.25 -28.97 65.66 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.92 0.711 . . . . 65.3 112.92 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.23 -28.49 62.19 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.597 0.237 . . . . 72.42 111.306 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.551 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.27 17.83 22.38 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.285 -0.416 . . . . 65.14 112.072 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.9 mt -68.33 -40.77 21.69 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-O 117.925 -1.036 . . . . 74.11 112.968 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.13 -3.0 12.46 Favored 'Trans proline' 0 C--N 1.382 2.305 0 CA-C-N 121.778 1.671 . . . . 74.23 113.885 168.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.551 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.0 m-85 -109.29 -164.01 0.91 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.201 0.6 . . . . 71.24 110.021 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.4 mtm 65.9 -169.9 0.2 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 125.035 1.334 . . . . 74.42 111.776 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -76.05 163.29 27.28 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.775 -0.648 . . . . 73.32 109.683 167.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -73.82 -24.73 59.83 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.726 -0.472 . . . . 73.02 109.726 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -66.09 -44.35 84.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.749 -0.659 . . . . 73.51 110.537 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' MET . . . . . 0.437 ' HG3' HD12 ' A' ' 11' ' ' LEU . 3.2 tpt -75.99 -25.81 56.14 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.421 -0.809 . . . . 73.34 111.205 -178.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -70.86 -44.65 65.94 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.501 1.12 . . . . 74.34 111.4 177.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -68.65 -33.38 73.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.13 -0.487 . . . . 74.21 111.566 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -66.21 -37.72 86.26 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.601 -0.727 . . . . 65.33 110.643 175.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.639 ' HA ' HD22 ' A' ' 11' ' ' LEU . . . -60.68 -37.66 82.36 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 113.571 0.952 . . . . 70.13 113.571 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -78.71 -27.44 44.94 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.133 0.271 . . . . 74.15 111.662 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -36.09 74.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.586 0.354 . . . . 75.45 111.153 172.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.48 HG23 ' HB3' ' A' ' 8' ' ' GLU . 1.6 m -81.24 -25.19 36.84 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.902 0.382 . . . . 72.31 111.583 178.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.441 HD23 ' HG2' ' A' ' 24' ' ' MET . 29.5 mt -66.58 -27.35 67.65 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.982 -0.449 . . . . 73.32 111.608 168.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.75 -18.17 64.17 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.332 0.493 . . . . 75.1 112.332 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.58 ' HD2' HD11 ' A' ' 4' ' ' LEU . 65.3 tttt -70.23 -56.48 6.69 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 110.07 -0.344 . . . . 75.22 110.07 170.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.8 mt -85.39 -20.23 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 112.833 0.679 . . . . 73.11 112.833 -163.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.87 95.88 Favored Pre-proline 0 CA--C 1.557 1.228 0 N-CA-C 114.202 1.186 . . . . 72.45 114.202 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.47 -4.28 14.04 Favored 'Trans proline' 0 C--N 1.377 2.075 0 CA-C-N 121.565 1.595 . . . . 70.44 114.161 172.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 48' ' ' LYS . 78.6 mt -85.38 133.57 34.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.433 -0.58 . . . . 74.44 109.433 176.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -89.19 24.43 2.16 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.763 0.653 . . . . 74.52 112.763 -172.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 76.64 -48.55 0.55 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 126.21 1.804 . . . . 71.25 112.732 173.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -64.48 -37.01 86.06 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.69 0.757 . . . . 72.41 109.657 170.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -68.67 -35.03 76.7 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.382 -1.281 . . . . 73.25 111.32 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -72.47 -24.9 61.25 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.919 0.487 . . . . 74.24 111.313 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -22.57 61.73 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.88 0.696 . . . . 63.34 112.88 -177.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.03 -29.48 49.42 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.837 0.351 . . . . 74.34 111.009 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.9 mt -88.89 -66.99 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.656 -0.702 . . . . 74.43 110.829 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 48.68 -105.76 0.16 Allowed 'General case' 0 CA--C 1.536 0.442 0 O-C-N 125.439 1.712 . . . . 72.44 112.304 -174.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 22.1 mm -115.41 104.31 16.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.595 -0.891 . . . . 75.01 108.595 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -110.41 -3.27 16.19 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.026 -0.534 . . . . 74.01 112.033 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -150.08 79.67 1.36 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.213 0.53 . . . . 54.3 111.63 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.448 ' O ' ' HG ' ' A' ' 69' ' ' LEU . . . -131.74 12.93 4.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.238 0.542 . . . . 65.03 110.389 173.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -76.34 -34.7 58.98 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.274 -0.876 . . . . 71.51 110.956 -176.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.697 ' HB2' HG23 ' A' ' 6' ' ' ILE . 8.6 mm-40 -75.88 -31.37 59.2 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.216 -0.902 . . . . 73.21 111.754 -175.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.492 HG21 ' HB2' ' A' ' 10' ' ' ASN . 3.9 m -85.07 -2.16 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 112.923 0.712 . . . . 71.11 112.923 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 65' ' ' ALA . 95.1 mt -72.14 -47.28 52.16 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.966 0.412 . . . . 74.31 110.63 174.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -101.36 76.09 1.67 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.656 0.741 . . . . 74.21 111.225 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.414 ' CE1' ' HA ' ' A' ' 68' ' ' VAL . 26.9 m170 -127.61 86.82 2.53 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 114.529 -1.214 . . . . 73.22 108.094 169.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.5 m170 69.87 168.54 0.3 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 125.147 1.379 . . . . 75.02 111.199 -169.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -127.77 25.31 6.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.343 0.592 . . . . 75.45 110.377 -178.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -84.91 95.0 8.9 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.176 -0.676 . . . . 74.42 109.176 175.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 61.6 105.49 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.154 1.382 . . . . 71.42 111.88 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 14.6 t60 . . . . . 0 N--CA 1.483 1.201 0 O-C-N 124.237 0.961 . . . . 74.31 110.547 -179.597 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 98.4 mt . . . . . 0 C--O 1.236 0.365 0 CA-C-O 120.497 0.189 . . . . 70.44 110.749 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.4 p -82.41 175.15 10.46 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.22 -0.445 . . . . 73.15 111.043 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.46 -38.37 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.303 -0.408 . . . . 73.12 110.34 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.72 -44.61 95.78 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 122.903 0.481 . . . . 75.31 110.989 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.439 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 46.3 mt-10 -65.79 -51.49 58.65 Favored 'General case' 0 CA--C 1.526 0.035 0 O-C-N 124.194 0.934 . . . . 71.34 112.413 -176.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.432 HG21 ' H ' ' A' ' 64' ' ' ALA . 3.0 m -74.18 -28.51 61.32 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 123.346 0.404 . . . . 61.04 111.759 -173.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -70.89 -32.92 70.04 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.385 -0.197 . . . . 72.34 111.437 176.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.468 HD12 HD12 ' A' ' 14' ' ' ILE . 54.8 tp -70.89 -35.52 72.36 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.621 0.248 . . . . 73.13 110.859 175.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.831 HD22 HD21 ' A' ' 23' ' ' LEU . 85.4 mt -67.07 -31.81 72.56 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 116.112 -0.495 . . . . 74.23 110.844 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -65.53 -25.3 67.39 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.841 0.857 . . . . 72.13 111.822 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.468 HD12 HD12 ' A' ' 11' ' ' LEU . 68.7 mt -72.54 -31.36 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 C-N-CA 123.213 0.605 . . . . 63.14 111.074 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.407 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . 94.7 m-85 -123.26 8.22 9.12 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 113.441 0.904 . . . . 72.53 113.441 -173.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.28 106.38 1.09 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.335 0.654 . . . . 72.44 112.316 -178.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -166.18 125.2 1.57 Allowed 'General case' 0 C--O 1.222 -0.384 0 O-C-N 124.127 0.892 . . . . 73.32 109.606 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.73 38.02 24.98 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.355 -0.45 . . . . 72.42 113.129 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.33 -147.66 36.25 Favored Glycine 0 C--N 1.334 0.468 0 N-CA-C 111.688 -0.565 . . . . 61.14 111.688 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.475 ' HG3' ' OE2' ' A' ' 54' ' ' GLU . 2.9 pptp? -93.28 -18.76 22.08 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.429 0.157 . . . . 75.33 110.63 177.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.474 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 18.5 mtp85 -65.93 -57.06 8.72 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.032 -0.531 . . . . 74.51 110.802 174.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.6 -29.0 74.17 Favored Glycine 0 C--O 1.209 -1.436 0 O-C-N 124.028 0.83 . . . . 62.13 112.659 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.831 HD21 HD22 ' A' ' 12' ' ' LEU . 26.3 tp -62.38 -44.57 96.14 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.191 0.596 . . . . 53.52 111.47 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.498 ' HG2' HD22 ' A' ' 46' ' ' LEU . 62.9 mtt -69.46 -36.7 76.84 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 122.514 0.326 . . . . 61.44 111.383 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 39.8 mm-40 -73.25 -30.91 63.79 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 123.29 0.369 . . . . 54.24 111.003 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.407 ' HB3' ' HB3' ' A' ' 15' ' ' TYR . 2.0 m-80 -68.62 -47.77 65.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.154 0.582 . . . . 52.05 111.182 174.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.576 HD12 HD21 ' A' ' 46' ' ' LEU . 44.7 mt -66.05 -48.11 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 O-C-N 123.647 0.592 . . . . 71.41 111.319 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.565 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 20.2 m-80 -70.61 -26.17 63.37 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.234 0.827 . . . . 75.43 113.234 -175.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.37 -28.09 41.92 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.688 0.28 . . . . 54.34 111.38 175.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.713 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -105.23 18.22 22.68 Favored 'General case' 0 C--O 1.221 -0.427 0 N-CA-C 112.18 0.437 . . . . 74.34 112.18 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.801 HD22 ' HG3' ' A' ' 39' ' ' ARG . 86.6 mt -60.19 -47.51 96.58 Favored Pre-proline 0 CA--C 1.554 1.119 0 N-CA-C 113.478 0.918 . . . . 63.22 113.478 176.455 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.07 -14.48 35.15 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.824 1.683 . . . . 62.21 113.747 175.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.713 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 70.3 m-85 -94.98 -8.43 36.94 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.843 0.354 . . . . 73.42 110.421 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.549 ' HE3' HD23 ' A' ' 31' ' ' LEU . 6.5 ttm -93.82 164.05 13.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.863 -0.608 . . . . 75.03 110.333 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.39 153.69 41.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.491 -0.777 . . . . 74.4 109.545 174.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.26 -41.6 97.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.983 0.364 . . . . 74.14 111.983 -179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.71 -34.78 72.3 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.867 0.365 . . . . 61.54 110.596 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.5 mtt -66.02 -36.52 83.49 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 115.65 -0.705 . . . . 73.24 112.328 174.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.801 ' HG3' HD22 ' A' ' 31' ' ' LEU . 48.8 ttp180 -74.49 -39.81 62.23 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.766 0.427 . . . . 72.34 111.661 -177.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -72.36 -29.04 63.42 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.831 0.348 . . . . 73.12 111.425 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.0 tp -72.09 -35.01 69.1 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.176 -0.466 . . . . 72.2 110.527 172.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.74 96.43 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 112.875 0.694 . . . . 62.15 112.875 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -70.18 -26.62 63.98 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.242 0.339 . . . . 73.3 111.849 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 -74.57 -42.37 58.88 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.437 0.295 . . . . 75.33 111.657 175.199 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.421 HG23 ' HB3' ' A' ' 8' ' ' GLU . 5.2 m -78.79 -33.6 46.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 73.05 112.213 -175.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.576 HD21 HD12 ' A' ' 27' ' ' ILE . 59.4 mt -69.85 -28.06 65.36 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 122.24 -0.288 . . . . 72.04 111.498 176.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.73 -17.62 62.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 122.564 0.346 . . . . 73.11 111.791 174.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -77.86 -32.26 51.9 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 122.471 0.308 . . . . 75.12 110.601 174.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.469 HG23 HD12 ' A' ' 52' ' ' LEU . 1.8 mt -98.94 -7.12 9.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.036 -0.529 . . . . 74.0 110.68 -175.1 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.29 -46.68 99.77 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-O 118.094 -0.955 . . . . 43.54 113.327 171.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.51 8.0 4.18 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.788 1.674 . . . . 72.41 114.294 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.469 HD12 HG23 ' A' ' 49' ' ' ILE . 78.1 mt -108.72 168.73 9.13 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.752 0.31 . . . . 72.21 110.81 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -110.37 -168.92 1.37 Allowed 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.159 -0.473 . . . . 73.11 110.602 174.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.475 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 2.9 mp0 -68.03 -29.0 67.88 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.927 0.491 . . . . 65.13 110.549 171.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.17 -45.99 71.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.435 0.694 . . . . 63.42 111.125 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -72.29 -33.58 67.52 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.347 0.499 . . . . 75.53 112.347 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.498 ' HD1' HD12 ' A' ' 60' ' ' LEU . 53.3 t80 -75.85 -25.08 55.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.094 0.247 . . . . 74.21 110.941 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.08 60.14 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.362 -0.211 . . . . 70.25 111.561 175.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.77 -32.96 58.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.423 0.289 . . . . 53.32 110.832 172.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.498 HD12 ' HD1' ' A' ' 57' ' ' TYR . 47.3 mt -70.8 -59.83 2.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.188 -0.671 . . . . 61.12 109.188 173.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.58 28.6 12.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.733 1.613 . . . . 73.1 113.832 171.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 33.1 mm 62.04 89.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.493 0 C-N-CA 124.562 1.145 . . . . 70.45 110.77 -171.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -97.03 -39.35 9.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.713 -1.131 . . . . 72.43 110.532 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.432 ' H ' HG21 ' A' ' 9' ' ' THR . . . -105.9 76.44 1.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.255 0.55 . . . . 42.24 112.364 -173.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.376 0 CA-C-N 115.166 -0.925 . . . . 50.23 110.13 172.128 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.8 mt . . . . . 0 C--O 1.238 0.478 0 N-CA-C 109.513 -0.551 . . . . 62.11 109.513 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -82.57 174.63 10.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.379 -0.373 . . . . 73.43 111.093 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.1 mm -62.68 -34.47 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 123.932 0.77 . . . . 73.54 111.181 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -74.18 -33.43 63.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 122.749 0.419 . . . . 65.11 111.884 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 49.6 mt-10 -73.78 -37.99 64.81 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.471 -0.331 . . . . 64.11 111.181 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.7 p -74.29 -27.21 60.63 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.049 -0.523 . . . . 61.34 112.088 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.467 ' O ' HG12 ' A' ' 14' ' ' ILE . 23.9 t-20 -67.77 -37.56 82.25 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.935 0.494 . . . . 74.21 110.914 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.458 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 17.7 tp -63.4 -37.9 89.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.449 0.7 . . . . 65.12 111.228 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 57.4 mt -68.28 -35.99 78.69 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.404 -0.816 . . . . 63.13 110.595 174.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -70.22 -24.22 63.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.975 0.91 . . . . 55.34 112.303 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 10' ' ' ASN . 40.6 mm -61.14 -45.26 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.023 0.529 . . . . 73.35 110.049 175.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -104.64 -76.0 0.61 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.72 -0.673 . . . . 75.53 111.171 -172.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 65.1 t30 53.4 76.16 0.22 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.257 1.423 . . . . 54.24 112.284 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -153.51 128.74 9.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.208 -0.906 . . . . 54.55 110.216 -177.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.92 37.68 92.35 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 124.057 0.848 . . . . 64.33 114.44 172.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.54 -143.94 37.91 Favored Glycine 0 C--N 1.335 0.527 0 N-CA-C 111.947 -0.461 . . . . 73.13 111.947 -176.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.512 ' HB2' HD12 ' A' ' 49' ' ' ILE . 1.2 pptp? -92.77 -14.84 27.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.554 -0.535 . . . . 61.32 109.554 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -67.92 -52.64 33.92 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.051 -0.977 . . . . 65.03 110.081 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.77 -27.92 73.49 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.269 -0.878 . . . . 50.43 112.75 174.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.492 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -60.02 -42.77 95.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.845 0.323 . . . . 63.14 110.937 172.189 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.868 ' HG2' HD22 ' A' ' 46' ' ' LEU . 51.9 mtt -68.92 -37.55 79.0 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.252 0.345 . . . . 64.54 111.711 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -67.05 -39.88 87.01 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.559 0.537 . . . . 74.2 111.742 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -76.33 -32.88 58.94 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 112.306 0.484 . . . . 75.3 112.306 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 31.7 mt -71.36 -44.99 71.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-O 119.271 -0.395 . . . . 73.51 111.29 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.478 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 m-80 -67.65 -33.84 75.75 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.262 0.467 . . . . 75.4 112.262 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.8 -31.64 64.99 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.256 0.348 . . . . 74.22 111.523 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.752 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.35 20.26 19.17 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 112.907 0.706 . . . . 72.12 112.907 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.478 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 80.0 mt -55.9 -47.68 98.25 Favored Pre-proline 0 CA--C 1.555 1.139 0 N-CA-C 113.286 0.847 . . . . 71.54 113.286 175.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.55 3.6 7.6 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.164 1.451 . . . . 72.13 114.245 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.752 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.7 m-85 -103.41 -29.6 11.1 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.705 0.288 . . . . 73.03 110.765 -178.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.3 ptp -81.9 170.63 15.41 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.885 -0.783 . . . . 60.11 108.885 169.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.09 155.11 40.26 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.205 0.316 . . . . 64.52 110.451 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -68.03 -32.75 73.34 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 111.99 0.367 . . . . 73.03 111.99 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.79 -36.09 72.87 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.184 0.516 . . . . 65.44 111.091 175.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 6.5 tpt -72.52 -26.96 61.96 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.956 -1.02 . . . . 72.03 110.881 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -73.38 -39.33 65.2 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.237 1.015 . . . . 73.43 111.371 178.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.18 -35.29 79.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.475 -0.33 . . . . 62.31 111.188 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.61 -40.17 76.76 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.646 -0.706 . . . . 65.44 110.82 173.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.571 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -58.86 -45.24 90.58 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 124.078 0.951 . . . . 62.1 113.47 -175.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -67.37 -28.97 68.39 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.569 0.543 . . . . 74.32 111.828 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.476 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 78.5 mtp180 -78.95 -33.77 44.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.355 -0.384 . . . . 70.11 111.544 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.426 ' O ' HG12 ' A' ' 49' ' ' ILE . 17.7 m -73.82 -27.24 61.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 122.781 0.433 . . . . 75.21 110.46 175.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.868 HD22 ' HG2' ' A' ' 24' ' ' MET . 38.8 mt -68.72 -30.81 69.53 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 111.406 0.15 . . . . 75.45 111.406 172.137 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.15 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 120.852 0.358 . . . . 72.43 111.407 173.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 74.3 mmtt -78.33 -48.51 15.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 115.938 -0.573 . . . . 75.31 110.261 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.512 HD12 ' HB2' ' A' ' 20' ' ' LYS . 16.0 pt -81.97 -13.3 12.4 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 N-CA-C 113.21 0.818 . . . . 53.23 113.21 -176.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -43.06 -48.36 14.85 Favored Pre-proline 0 N--CA 1.486 1.36 0 N-CA-C 116.338 1.977 . . . . 71.53 116.338 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -82.59 27.62 0.6 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 CA-C-N 122.301 1.857 . . . . 73.22 115.386 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.9 mt -102.11 143.55 31.8 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.78 0.8 . . . . 74.21 111.887 177.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.615 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 22.7 m -101.62 26.31 7.49 Favored 'General case' 0 CA--C 1.56 1.363 0 CA-C-N 114.023 -1.444 . . . . 70.23 110.854 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 77.86 -51.26 0.51 Allowed 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 125.995 1.718 . . . . 74.01 112.652 173.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -70.11 -31.27 68.75 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.701 0.8 . . . . 53.24 110.986 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.615 ' OE1' ' HB ' ' A' ' 53' ' ' THR . 26.4 mp0 -67.53 -35.52 79.25 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.898 -0.592 . . . . 72.23 111.011 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -75.04 -27.25 59.97 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-N 115.807 -0.633 . . . . 75.4 110.335 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.07 -22.73 60.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 117.877 0.308 . . . . 73.11 111.461 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -79.17 -31.21 43.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.957 0.503 . . . . 73.53 111.634 175.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.7 mt -89.14 -51.66 5.47 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.565 -0.289 . . . . 63.15 110.586 -178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.68 -121.71 1.83 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.226 1.81 . . . . 73.44 111.878 178.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 24.3 mm -95.88 100.48 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.401 -1.333 . . . . 65.22 107.401 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -92.06 -26.32 18.37 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.677 -0.692 . . . . 75.51 112.112 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -139.77 88.07 2.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.536 0.684 . . . . 42.2 111.872 -179.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.485 0 CA-C-O 121.51 0.671 . . . . 74.24 110.51 175.107 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.448 HD22 HG23 ' A' ' 45' ' ' THR . 74.8 mt . . . . . 0 CA--C 1.514 -0.424 0 CA-C-O 120.927 0.394 . . . . 63.41 110.142 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.2 166.97 20.9 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.227 -0.897 . . . . 73.44 109.848 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.5 mm -67.94 -24.13 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.17 0.588 . . . . 65.3 111.982 -174.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.23 -34.42 65.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.862 -0.608 . . . . 62.01 110.676 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 40.6 mt-10 -73.51 -37.14 65.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.454 0.471 . . . . 71.24 111.357 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -73.21 -27.66 61.74 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.496 0.498 . . . . 71.43 111.687 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.445 ' O ' HG12 ' A' ' 14' ' ' ILE . 9.0 t-20 -64.48 -40.07 94.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.003 0.521 . . . . 61.05 111.046 171.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.582 HD21 ' HA ' ' A' ' 42' ' ' ALA . 16.7 tp -60.7 -34.34 74.22 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.067 0.947 . . . . 73.32 111.561 175.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.722 HD22 HD21 ' A' ' 23' ' ' LEU . 40.0 mt -71.07 -35.81 72.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.627 -0.715 . . . . 71.24 110.572 178.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.594 ' HA ' HD12 ' A' ' 62' ' ' ILE . 17.1 t -71.23 -23.75 62.06 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.32 -0.854 . . . . 74.11 112.902 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 10' ' ' ASN . 27.8 mm -61.87 -45.78 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.883 0.473 . . . . 72.42 110.142 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -106.33 -84.16 0.51 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.612 -0.709 . . . . 73.12 111.265 -174.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.473 ' H ' HD13 ' A' ' 23' ' ' LEU . 65.0 t30 46.58 87.02 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.238 1.415 . . . . 74.43 112.894 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -93.17 -83.98 0.3 Allowed 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.027 -0.421 . . . . 73.32 110.575 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -120.13 83.81 0.36 Allowed Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 109.987 -1.245 . . . . 73.43 109.987 177.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.07 -134.94 20.67 Favored Glycine 0 N--CA 1.449 -0.46 0 O-C-N 124.395 0.703 . . . . 44.31 111.422 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 3.0 pptp? -97.91 -22.03 16.56 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 123.8 0.353 . . . . 74.3 111.157 178.297 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HB2' ' OE1' ' A' ' 54' ' ' GLU . 53.3 ttp180 -70.23 -51.04 33.77 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.568 0.543 . . . . 72.15 110.33 -178.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.33 -29.18 71.95 Favored Glycine 0 C--O 1.223 -0.571 0 O-C-N 124.183 0.927 . . . . 42.32 112.592 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.722 HD21 HD22 ' A' ' 12' ' ' LEU . 26.8 tp -63.14 -41.86 99.38 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.264 0.625 . . . . 71.43 110.97 172.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.779 ' HG2' HD22 ' A' ' 46' ' ' LEU . 58.0 mtt -67.42 -37.91 83.77 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 122.979 0.512 . . . . 64.32 111.64 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 49.0 mm-40 -67.09 -37.8 84.58 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 123.411 0.445 . . . . 74.42 110.978 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -71.27 -33.89 70.19 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 112.388 0.514 . . . . 65.41 112.388 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.9 mt -71.56 -46.56 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 123.183 0.302 . . . . 43.23 111.049 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.409 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 22.2 m-80 -71.95 -31.23 66.11 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.053 0.761 . . . . 65.25 113.053 -176.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.87 -30.37 50.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.541 0.2 . . . . 72.43 111.541 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.753 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.68 18.42 19.35 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.448 0.536 . . . . 35.4 112.448 -178.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 71.9 mt -57.81 -46.34 99.74 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 113.521 0.934 . . . . 63.22 113.521 171.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -67.96 -18.26 46.47 Favored 'Trans proline' 0 C--N 1.383 2.353 0 CA-C-N 121.666 1.631 . . . . 73.4 113.399 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.753 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 90.7 m-85 -90.44 -32.78 16.25 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 122.376 0.27 . . . . 74.21 111.574 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptp -81.6 168.9 17.69 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.608 0.242 . . . . 61.01 110.761 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.55 171.81 14.57 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.961 -0.563 . . . . 64.25 112.029 -177.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -36.85 85.44 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.57 -0.741 . . . . 64.52 112.936 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.22 -35.84 66.37 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.394 0.434 . . . . 73.14 110.753 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 50.6 ttm -73.99 -30.48 62.5 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.45 0.469 . . . . 74.33 111.065 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.4 mtm-85 -68.8 -41.56 78.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.766 0.284 . . . . 74.23 111.766 174.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.09 -47.68 85.2 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 123.838 0.711 . . . . 65.34 111.065 175.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.5 tp -61.49 -41.93 98.02 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 124.568 1.168 . . . . 65.3 111.58 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.582 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -55.73 -43.91 77.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.514 1.134 . . . . 74.41 113.468 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -64.12 -36.16 83.13 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.888 0.742 . . . . 61.42 112.441 -176.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -80.12 -34.86 37.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.406 -0.361 . . . . 64.14 111.964 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.448 HG23 HD22 ' A' ' 4' ' ' LEU . 13.7 m -72.28 -39.93 67.98 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.645 0.378 . . . . 65.43 111.618 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.779 HD22 ' HG2' ' A' ' 24' ' ' MET . 63.9 mt -65.93 -29.0 69.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.194 0.442 . . . . 74.42 112.194 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.13 -23.02 63.92 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 123.508 0.505 . . . . 41.03 112.189 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -87.49 -27.82 22.42 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 122.43 0.292 . . . . 71.23 111.665 -178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.56 HG23 HD12 ' A' ' 52' ' ' LEU . 9.9 mt -98.11 -12.39 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 121.144 0.497 . . . . 73.12 110.691 -176.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.01 99.31 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 114.456 1.28 . . . . 60.51 114.456 173.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.99 -12.56 26.04 Favored 'Trans proline' 0 C--N 1.385 2.486 0 CA-C-N 121.863 1.701 . . . . 74.34 114.414 174.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.56 HD12 HG23 ' A' ' 49' ' ' ILE . 72.6 mt -83.46 139.32 33.01 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.625 -0.509 . . . . 75.11 109.625 -176.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 56' ' ' GLU . 11.4 t -82.8 168.41 17.18 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 120.857 -0.337 . . . . 75.23 110.252 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 4.9 tp10 -64.13 -40.34 95.96 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.931 0.892 . . . . 74.41 111.404 -174.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -74.59 -29.73 61.43 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.862 -0.608 . . . . 70.43 111.597 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 53' ' ' THR . 51.5 tt0 -72.11 -36.25 69.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.224 -0.443 . . . . 72.43 111.324 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -74.33 -23.16 59.01 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.318 -0.401 . . . . 70.31 110.744 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.71 -24.71 67.05 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.964 0.357 . . . . 72.25 111.964 174.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -76.17 -25.86 55.64 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.93 0.492 . . . . 75.32 111.588 175.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 29.6 mt -93.29 -53.56 4.05 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.258 -0.428 . . . . 74.43 110.42 -175.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 63.92 -85.03 0.02 OUTLIER 'General case' 0 C--N 1.351 0.645 0 C-N-CA 126.477 1.911 . . . . 70.13 112.603 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.594 HD12 ' HA ' ' A' ' 13' ' ' SER . 49.5 mm -120.12 -44.79 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 108.838 -0.801 . . . . 74.41 108.838 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 72.12 -79.83 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.117 1.767 . . . . 74.51 112.669 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.08 69.22 1.48 Allowed 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 121.202 0.525 . . . . 72.24 112.147 -172.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.535 0 CA-C-O 121.304 0.574 . . . . 62.4 111.237 176.245 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.3 mt . . . . . 0 C--O 1.239 0.509 0 N-CA-C 109.22 -0.659 . . . . 75.04 109.22 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 14.8 t -72.82 156.09 39.26 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.905 -0.776 . . . . 70.04 108.905 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 48.0 mt -62.39 -27.26 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 123.853 0.861 . . . . 64.54 111.505 -173.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -73.12 -35.07 66.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.909 0.483 . . . . 63.05 111.877 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -73.18 -35.42 66.39 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.262 0.225 . . . . 34.41 110.977 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.611 HG21 ' H ' ' A' ' 64' ' ' ALA . 5.7 m -73.5 -28.95 62.18 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.852 0.72 . . . . 64.32 110.596 178.005 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -66.15 -39.69 90.0 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.904 -0.589 . . . . 71.41 110.879 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.465 HD13 ' HG3' ' A' ' 38' ' ' MET . 62.8 tp -67.05 -34.3 77.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.838 0.455 . . . . 70.24 111.064 177.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.635 HD13 ' HE1' ' A' ' 57' ' ' TYR . 72.4 mt -67.97 -32.86 73.57 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.585 -0.734 . . . . 73.34 111.088 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -72.01 -37.28 69.82 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.485 0.714 . . . . 74.51 112.484 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 90.3 mt -69.07 -45.48 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-O 120.968 0.414 . . . . 63.4 110.808 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -102.02 28.08 6.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.125 -0.489 . . . . 72.44 111.545 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.428 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 12.9 t-20 -73.27 100.3 3.1 Favored 'General case' 0 C--N 1.344 0.339 0 O-C-N 123.606 0.567 . . . . 75.22 110.247 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -113.84 -69.25 0.87 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.344 -0.844 . . . . 71.33 111.479 -174.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -146.56 64.0 0.44 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.893 -0.67 . . . . 34.13 111.869 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.19 -157.41 40.85 Favored Glycine 0 C--O 1.225 -0.42 0 C-N-CA 121.443 -0.408 . . . . 51.32 112.1 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -69.53 -33.9 73.47 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 122.595 0.358 . . . . 72.22 111.495 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.497 ' HD3' ' HA ' ' A' ' 21' ' ' ARG . 12.3 mmt180 -73.45 -43.46 60.25 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-O 118.803 -0.618 . . . . 65.22 112.133 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.82 -27.72 71.58 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 120.982 -0.628 . . . . 54.13 112.905 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.596 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.3 mm? -67.56 -54.49 19.47 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 122.843 0.457 . . . . 72.22 111.27 170.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.765 ' HG2' HD22 ' A' ' 46' ' ' LEU . 30.8 mtt -64.45 -44.46 91.02 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.014 0.746 . . . . 73.31 113.014 -174.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 18.1 mm-40 -68.9 -36.6 78.22 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 122.71 0.404 . . . . 63.32 111.795 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -70.91 -46.28 62.8 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.955 -0.387 . . . . 75.43 109.955 177.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.424 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 34.5 mt -62.29 -41.96 93.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.32 0.648 . . . . 74.55 112.338 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.14 -42.82 95.69 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.308 0.643 . . . . 71.22 112.183 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -27.34 36.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 72.35 112.073 -177.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.751 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -97.48 11.39 36.95 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 113.173 0.805 . . . . 74.31 113.173 -174.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 55.4 mt -57.9 -45.88 99.76 Favored Pre-proline 0 CA--C 1.557 1.215 0 N-CA-C 114.458 1.281 . . . . 73.0 114.458 177.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.3 -12.21 31.47 Favored 'Trans proline' 0 C--N 1.384 2.401 0 C-N-CA 121.815 1.677 . . . . 75.31 113.999 173.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.751 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 74.3 m-85 -96.77 -7.84 32.75 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.36 0.264 . . . . 75.51 111.24 -178.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.3 mtt -83.05 154.91 24.18 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.317 0.58 . . . . 73.35 111.846 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.74 158.93 35.23 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 114.386 -1.279 . . . . 43.45 109.048 171.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -47.69 -38.94 16.16 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.753 1.221 . . . . 74.32 113.819 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.18 -51.69 42.87 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 123.352 0.407 . . . . 64.24 111.697 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.465 ' HG3' HD13 ' A' ' 11' ' ' LEU . 0.5 OUTLIER -73.74 -28.23 61.58 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.867 0.691 . . . . 74.0 112.867 -173.672 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -68.03 -55.72 11.55 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 123.686 0.794 . . . . 75.3 111.566 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -70.73 -29.23 65.44 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.855 0.687 . . . . 71.32 112.855 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.2 tp -63.8 -38.91 92.86 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 123.734 0.646 . . . . 75.42 110.7 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.473 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -60.86 -37.05 80.76 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 113.711 1.004 . . . . 75.21 113.711 -175.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.62 -37.12 86.47 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.39 0.431 . . . . 51.11 110.743 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -80.07 -31.75 39.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.666 -0.697 . . . . 75.25 111.327 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.1 m -69.66 -43.11 73.24 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 122.856 0.463 . . . . 53.21 110.355 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.765 HD22 ' HG2' ' A' ' 24' ' ' MET . 85.9 mt -68.75 -29.39 67.78 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.654 -0.703 . . . . 72.31 111.731 178.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.79 -24.15 61.69 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 123.438 0.461 . . . . 73.41 111.474 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -87.52 -33.03 19.1 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.347 0.499 . . . . 72.41 112.347 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 34.8 pt -90.92 -13.93 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 112.894 0.702 . . . . 52.31 112.894 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -49.78 91.9 Favored Pre-proline 0 N--CA 1.48 1.067 0 CA-C-O 117.797 -1.097 . . . . 64.55 113.619 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -73.87 -10.73 23.37 Favored 'Trans proline' 0 C--N 1.384 2.435 0 C-N-CA 121.708 1.605 . . . . 75.44 113.213 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 ' HG2' ' A' ' 56' ' ' GLU . 78.0 mt -81.55 148.5 29.11 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.667 -0.494 . . . . 73.2 109.667 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.526 HG23 ' H ' ' A' ' 56' ' ' GLU . 7.1 t -77.95 167.52 21.35 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.399 -0.593 . . . . 65.2 109.399 170.264 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -66.79 -31.76 72.6 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.886 0.474 . . . . 74.41 110.415 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -73.31 -29.71 62.88 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.36 -0.837 . . . . 74.13 111.008 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.547 ' HG2' HD22 ' A' ' 52' ' ' LEU . 4.9 tp10 -66.73 -46.42 75.53 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.861 0.464 . . . . 74.21 109.793 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.635 ' HE1' HD13 ' A' ' 12' ' ' LEU . 76.0 t80 -67.36 -29.09 68.54 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 123.774 0.671 . . . . 62.45 111.552 177.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.64 -33.45 72.8 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.422 0.527 . . . . 52.34 112.422 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -80.51 -29.5 37.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.319 -0.4 . . . . 75.42 111.514 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.0 mt -104.01 16.7 25.7 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.705 0.631 . . . . 64.13 112.705 -171.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.75 -69.97 0.1 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 62.3 113.294 -169.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mp -121.68 89.55 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 107.227 -1.398 . . . . 71.4 107.227 169.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -90.02 -64.98 1.06 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.997 -1.456 . . . . 64.05 109.945 -178.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.611 ' H ' HG21 ' A' ' 9' ' ' THR . . . -121.35 96.34 5.05 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.37 -0.377 . . . . 75.32 110.853 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.61 0 CA-C-O 120.904 0.383 . . . . 73.0 110.546 175.031 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt . . . . . 0 CA--C 1.517 -0.29 0 CA-C-O 120.474 0.178 . . . . 73.43 110.694 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.1 t -88.56 170.69 10.65 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.014 -0.736 . . . . 70.23 109.014 173.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -66.79 -30.97 51.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.039 0.535 . . . . 72.33 111.185 -172.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.406 ' O ' HD21 ' A' ' 41' ' ' LEU . 1.9 mp0 -62.74 -49.82 73.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.252 0.621 . . . . 65.23 111.708 177.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -66.06 -39.27 89.95 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.429 0.691 . . . . 75.11 111.864 -175.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.401 ' HA ' HD12 ' A' ' 12' ' ' LEU . 3.8 p -74.63 -26.34 59.82 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.855 0.687 . . . . 71.12 112.855 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -67.76 -32.48 73.11 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.052 0.541 . . . . 64.31 110.919 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.477 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 16.6 tp -64.55 -39.58 94.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.409 0.684 . . . . 52.51 111.048 172.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 9' ' ' THR . 55.4 mt -69.53 -32.14 70.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.381 -0.827 . . . . 74.4 111.037 178.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.529 ' HA ' HD12 ' A' ' 62' ' ' ILE . 22.6 t -69.37 -24.85 63.93 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 51.42 111.867 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.8 mt -67.19 -44.27 87.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 122.691 0.396 . . . . 72.15 110.341 174.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.449 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 95.5 m-85 -95.98 -86.84 0.3 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.313 0.486 . . . . 75.3 112.313 -175.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.551 ' HA ' HD21 ' A' ' 23' ' ' LEU . 13.4 t-20 53.87 85.32 0.05 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.905 1.282 . . . . 64.05 112.041 -171.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -88.82 -81.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.182 -0.463 . . . . 74.41 111.104 -177.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -163.52 53.6 0.29 Allowed Glycine 0 CA--C 1.499 -0.937 0 N-CA-C 110.5 -1.04 . . . . 73.1 110.5 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.83 -175.28 16.24 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.729 -0.948 . . . . 65.52 110.729 -175.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.458 ' HD3' HG22 ' A' ' 49' ' ' ILE . 3.0 pptp? -83.92 -18.54 37.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.696 0.248 . . . . 71.13 111.565 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.53 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 22.5 ttm180 -65.25 -52.18 56.09 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 123.824 0.702 . . . . 73.45 109.319 172.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.76 -29.6 75.46 Favored Glycine 0 N--CA 1.449 -0.467 0 O-C-N 124.516 1.135 . . . . 54.54 113.378 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.3 mm? -64.07 -42.31 97.02 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 116.901 0.351 . . . . 53.24 110.925 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.657 ' HG2' HD22 ' A' ' 46' ' ' LEU . 64.0 mtt -69.07 -41.19 77.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.848 0.314 . . . . 74.23 111.848 178.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 7.5 mm-40 -65.01 -36.24 83.76 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.61 0.243 . . . . 74.3 111.48 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.449 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.9 m-80 -78.85 -44.1 23.66 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 112.56 0.578 . . . . 72.35 112.56 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.419 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 52.6 mt -64.55 -51.34 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 119.17 -0.443 . . . . 71.21 111.837 -178.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -62.41 -37.52 86.11 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.145 0.794 . . . . 62.41 113.145 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.69 -30.13 27.02 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.491 0.552 . . . . 72.43 112.491 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.528 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -104.47 19.54 20.12 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.229 0.455 . . . . 71.44 112.229 -175.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 89.5 mt -55.05 -45.36 99.85 Favored Pre-proline 0 CA--C 1.559 1.292 0 N-CA-C 113.629 0.974 . . . . 62.41 113.629 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -67.89 -13.55 38.79 Favored 'Trans proline' 0 C--N 1.394 2.952 0 C-N-CA 122.063 1.842 . . . . 74.23 114.094 174.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.528 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.9 m-85 -92.03 -10.44 39.19 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.517 0.198 . . . . 75.34 111.158 178.049 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.0 mtm -99.95 -177.97 3.71 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.34 0.59 . . . . 71.33 111.902 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.37 159.86 28.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.03 -0.987 . . . . 74.43 110.23 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.57 -36.59 83.02 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.203 0.601 . . . . 52.4 111.596 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.45 -35.93 73.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.078 0.466 . . . . 65.21 110.254 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -25.98 61.33 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.456 -0.793 . . . . 53.32 111.839 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 -68.82 -41.83 78.07 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.117 0.567 . . . . 55.11 110.838 177.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -73.04 -31.74 64.63 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.324 -0.398 . . . . 74.24 111.652 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.406 HD21 ' O ' ' A' ' 7' ' ' GLU . 42.9 tp -68.17 -34.66 76.71 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.046 -0.525 . . . . 74.54 111.062 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.477 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -59.0 -41.37 87.49 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 123.625 0.77 . . . . 61.11 112.566 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -66.47 -35.26 79.83 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 123.828 0.705 . . . . 74.43 111.493 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -69.88 -42.82 72.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.963 -0.562 . . . . 72.32 111.447 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.0 m -72.53 -36.75 68.38 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.684 0.615 . . . . 73.22 111.195 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.657 HD22 ' HG2' ' A' ' 24' ' ' MET . 82.5 mt -67.37 -28.32 67.85 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.196 0.443 . . . . 64.41 112.196 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.9 61.35 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.762 0.315 . . . . 73.03 111.534 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -83.7 -32.91 25.3 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.963 0.505 . . . . 71.22 111.315 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.712 HG23 HD12 ' A' ' 52' ' ' LEU . 7.3 mt -94.54 -10.86 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 121.245 0.545 . . . . 73.14 110.797 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.65 -45.77 99.91 Favored Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 114.509 1.3 . . . . 61.4 114.509 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -77.63 -1.88 12.04 Favored 'Trans proline' 0 C--N 1.388 2.61 0 CA-C-N 121.854 1.698 . . . . 72.13 113.605 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.712 HD12 HG23 ' A' ' 49' ' ' ILE . 57.7 mt -86.56 140.79 29.55 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.061 -0.718 . . . . 61.31 109.061 174.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 t -84.22 170.37 13.81 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 108.521 -0.918 . . . . 65.01 108.521 168.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.464 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 15.0 tp10 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.687 0.795 . . . . 64.13 112.88 -166.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -75.29 -28.2 59.64 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.216 -0.902 . . . . 75.54 112.497 -173.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.65 -52.18 66.63 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.573 0.546 . . . . 71.34 112.273 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -69.12 -24.75 64.15 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.624 0.578 . . . . 71.13 111.841 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.4 -29.45 70.51 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 111.798 0.296 . . . . 71.04 111.798 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -81.99 -15.03 55.1 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.589 0.589 . . . . 74.31 112.589 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.35 -52.21 6.37 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.363 -0.21 . . . . 73.42 110.675 175.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 57.66 -101.05 0.12 Allowed 'General case' 0 C--N 1.354 0.796 0 O-C-N 125.168 1.542 . . . . 62.24 111.457 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.529 HD12 ' HA ' ' A' ' 13' ' ' SER . 40.1 mm -113.89 90.94 1.61 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 107.635 -1.246 . . . . 63.13 107.635 169.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -96.28 105.27 17.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.916 -0.772 . . . . 72.25 108.916 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 70.66 -166.13 0.15 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 125.4 1.48 . . . . 72.34 109.995 -166.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.685 0 C-N-CA 126.121 1.768 . . . . 55.34 114.866 173.197 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 70.9 mt . . . . . 0 C--O 1.238 0.461 0 N-CA-C 110.256 -0.276 . . . . 63.35 110.256 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.9 t -84.3 170.24 13.87 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.602 -0.518 . . . . 74.33 109.602 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.63 -33.71 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.656 0.782 . . . . 71.41 111.014 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.41 -34.82 65.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.259 0.466 . . . . 73.34 112.259 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 53.8 mt-10 -70.15 -39.59 75.28 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.419 0.155 . . . . 62.31 111.419 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.504 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.5 m -73.91 -28.03 61.33 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 123.562 0.539 . . . . 72.24 110.815 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -65.62 -41.61 92.51 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.949 0.5 . . . . 74.33 110.334 174.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' A' ' 42' ' ' ALA . 51.4 tp -68.15 -34.6 76.64 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.244 -0.889 . . . . 73.55 111.256 177.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 91.5 mt -65.1 -36.02 82.96 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 115.656 -0.702 . . . . 70.11 111.656 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.1 m -65.62 -28.28 69.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 123.811 0.694 . . . . 75.31 112.148 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.411 HD12 ' HA ' ' A' ' 11' ' ' LEU . 55.4 mt -71.39 -37.78 66.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.003 0.521 . . . . 72.41 110.945 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -119.11 27.33 8.91 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.742 0.275 . . . . 72.41 111.742 -174.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.527 ' HA ' HD21 ' A' ' 23' ' ' LEU . 9.7 t30 -76.94 101.21 5.87 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.058 -0.519 . . . . 53.24 111.736 -172.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.458 ' HG3' HD21 ' A' ' 26' ' ' ASN . 26.8 mm-40 -118.66 -117.88 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.488 -0.778 . . . . 75.11 112.249 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -96.64 87.83 0.96 Allowed Glycine 0 C--N 1.341 0.84 0 C-N-CA 121.325 -0.464 . . . . 43.22 112.985 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.28 -150.91 46.16 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 111.645 -0.582 . . . . 51.21 111.645 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.644 ' HG2' ' HB3' ' A' ' 54' ' ' GLU . 4.7 pttp -85.38 -17.39 36.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.751 -0.38 . . . . 72.24 110.431 175.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -67.45 -48.84 66.07 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.894 -0.593 . . . . 71.13 109.942 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.35 -33.08 86.29 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 123.89 0.744 . . . . 72.35 113.342 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.527 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.9 mm? -64.8 -51.78 60.38 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.9 0.35 . . . . 73.51 111.894 176.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.5 mtp -70.77 -34.6 71.98 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.457 0.473 . . . . 74.23 111.648 -173.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -66.45 -43.85 84.42 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 111.974 0.361 . . . . 74.13 111.974 175.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.458 HD21 ' HG3' ' A' ' 17' ' ' GLU . 79.1 m-20 -69.4 -40.87 77.08 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 112.523 0.564 . . . . 74.11 112.523 -178.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.496 ' CG2' ' HB1' ' A' ' 42' ' ' ALA . 63.8 mt -65.89 -44.75 92.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 119.149 -0.453 . . . . 51.31 111.426 -177.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.427 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 49.2 m-80 -70.12 -25.78 63.65 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.562 0.579 . . . . 70.32 112.562 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.86 -27.97 33.23 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 111.655 0.243 . . . . 74.1 111.655 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -98.28 7.65 45.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.934 0.346 . . . . 73.44 111.934 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.427 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 89.2 mt -58.55 -45.38 99.67 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-O 118.3 -0.857 . . . . 71.13 112.955 173.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -64.0 -5.77 9.89 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 122.567 2.178 . . . . 53.42 114.598 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -108.23 -134.56 0.34 Allowed 'General case' 0 C--O 1.242 0.665 0 N-CA-C 108.172 -1.047 . . . . 63.13 108.172 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtt 61.11 -105.44 0.2 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.784 1.234 . . . . 62.44 110.875 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -159.19 -69.08 0.08 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.933 0.893 . . . . 71.41 109.355 172.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 176.01 -40.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.478 1.511 . . . . 71.31 108.507 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.22 -50.39 63.96 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.864 -1.062 . . . . 54.52 110.222 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 42.9 mtp -64.37 -27.9 69.33 Favored 'General case' 0 C--O 1.209 -1.066 0 O-C-N 123.839 0.712 . . . . 73.52 112.212 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -73.73 -49.76 24.04 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.448 0.468 . . . . 73.11 111.705 -176.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -72.47 -32.0 65.88 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.85 0.315 . . . . 73.42 111.85 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.4 tp -69.12 -33.62 73.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.087 -0.506 . . . . 51.12 110.7 174.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.496 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -66.37 -31.67 72.58 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-N 116.006 -0.543 . . . . 63.2 112.084 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -70.38 -31.49 68.75 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.623 0.577 . . . . 75.02 111.381 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 44' ' ' ARG . 43.8 mtt180 -71.05 -38.69 72.53 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.284 0.365 . . . . 75.41 111.55 173.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.487 ' O ' HG13 ' A' ' 49' ' ' ILE . 13.8 m -73.56 -33.92 64.92 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 123.537 0.523 . . . . 70.45 111.227 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 90.1 mt -67.09 -31.92 72.73 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.547 0.339 . . . . 71.32 111.638 174.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.52 -20.34 62.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 123.582 0.551 . . . . 71.35 111.635 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 0.2 OUTLIER -81.22 -40.66 23.48 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.621 -0.263 . . . . 70.42 111.091 176.67 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.493 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.0 mt -89.73 -15.86 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 112.215 0.45 . . . . 71.43 112.215 -172.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -47.51 98.57 Favored Pre-proline 0 CA--C 1.555 1.17 0 N-CA-C 114.13 1.159 . . . . 71.14 114.13 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.21 0.97 9.32 Favored 'Trans proline' 0 C--N 1.378 2.107 0 CA-C-N 121.855 1.698 . . . . 42.5 113.789 174.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' A' ' 49' ' ' ILE . 88.0 mt -87.23 158.08 19.18 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.033 0.444 . . . . 45.4 110.367 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.624 HG23 ' H ' ' A' ' 56' ' ' GLU . 7.5 t -102.02 158.49 16.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.748 -0.834 . . . . 73.01 108.748 169.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.644 ' HB3' ' HG2' ' A' ' 20' ' ' LYS . 4.8 pt-20 -87.2 -4.4 59.1 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.719 0.295 . . . . 74.32 111.064 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.04 -45.44 70.44 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.563 -0.744 . . . . 55.12 109.516 166.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.624 ' H ' HG23 ' A' ' 53' ' ' THR . 29.8 tt0 -76.93 -34.35 57.67 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.889 -0.596 . . . . 74.15 110.854 177.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.417 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 54.9 t80 -67.4 -25.08 65.77 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 123.271 0.357 . . . . 72.33 110.998 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.05 -37.99 81.97 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.094 -0.379 . . . . 64.24 111.246 174.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -79.87 -19.94 47.08 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.386 0.513 . . . . 71.21 112.386 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 83.3 mt -84.06 -68.23 0.73 Allowed 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.854 -0.424 . . . . 73.53 109.854 173.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.82 -127.7 2.36 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 125.525 1.53 . . . . 64.23 111.452 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 39.4 mm -99.34 95.34 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 107.974 -1.121 . . . . 63.14 107.974 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -106.34 -7.44 17.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.278 -0.874 . . . . 75.3 111.303 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.504 ' H ' HG21 ' A' ' 9' ' ' THR . . . -137.12 -172.84 3.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.677 -0.861 . . . . 72.45 108.677 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.329 0 C-N-CA 124.854 1.262 . . . . 51.0 111.802 -175.467 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 5.1 mp . . . . . 0 C--O 1.238 0.485 0 N-CA-C 107.723 -1.214 . . . . 63.41 107.723 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.703 HG22 ' HG3' ' A' ' 8' ' ' GLU . 4.2 t -76.14 171.54 14.33 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 109.472 -0.566 . . . . 73.22 109.472 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 9.1 mm -61.78 -36.67 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.142 0.577 . . . . 74.44 111.859 -170.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.02 -24.9 59.62 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.172 0.805 . . . . 72.42 113.172 176.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.703 ' HG3' HG22 ' A' ' 5' ' ' THR . 46.7 mt-10 -75.42 -38.78 59.62 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 117.762 0.256 . . . . 61.3 111.053 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.12 -28.68 62.4 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.464 0.478 . . . . 74.3 111.871 174.119 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.449 ' O ' HG13 ' A' ' 14' ' ' ILE . 14.5 t-20 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.472 0.482 . . . . 71.23 110.652 170.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.466 ' HA ' HD12 ' A' ' 14' ' ' ILE . 49.2 tp -64.74 -33.6 76.35 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 124.028 0.83 . . . . 74.4 111.646 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.595 ' HA ' HD11 ' A' ' 23' ' ' LEU . 81.1 mt -59.59 -47.74 84.38 Favored 'General case' 0 C--O 1.214 -0.812 0 O-C-N 124.032 0.833 . . . . 62.34 111.731 175.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 46.2 p -71.55 -23.2 61.72 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.711 0.634 . . . . 71.24 112.711 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.466 HD12 ' HA ' ' A' ' 11' ' ' LEU . 87.9 mt -64.73 -51.52 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 122.766 0.426 . . . . 72.5 111.278 175.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.551 ' HB2' HD13 ' A' ' 23' ' ' LEU . 68.9 m-85 -106.3 29.8 6.51 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.057 0.392 . . . . 73.25 112.057 -174.47 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 14.7 t-20 -84.09 102.45 12.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.247 -0.433 . . . . 63.54 111.415 -176.102 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -123.22 -26.7 4.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.855 -0.611 . . . . 73.12 111.74 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.12 69.5 0.17 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.698 -0.763 . . . . 64.52 112.055 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.83 -149.28 46.12 Favored Glycine 0 N--CA 1.45 -0.372 0 O-C-N 123.859 0.388 . . . . 52.01 112.439 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.854 ' HE3' ' HA ' ' A' ' 53' ' ' THR . 0.6 OUTLIER -90.4 -11.17 41.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.741 0.305 . . . . 64.22 110.436 178.824 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -65.5 -52.86 49.7 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 123.963 0.905 . . . . 73.12 109.283 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.8 -30.34 74.4 Favored Glycine 0 C--O 1.218 -0.888 0 CA-C-N 114.966 -1.015 . . . . 41.5 112.622 174.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.716 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -62.28 -46.95 86.47 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 117.15 0.475 . . . . 63.11 111.353 175.32 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.614 ' HG2' HD22 ' A' ' 46' ' ' LEU . 46.3 mtt -63.72 -43.77 95.56 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.242 0.617 . . . . 74.34 112.369 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.11 -36.0 64.19 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.584 0.553 . . . . 75.33 112.02 -176.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -74.54 -33.67 62.79 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 119.534 -0.27 . . . . 64.02 111.52 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.488 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 11.9 mt -66.6 -49.73 72.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-O 119.282 -0.39 . . . . 71.04 111.17 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -65.27 -35.59 81.5 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.436 0.532 . . . . 74.44 112.436 -177.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.62 -34.53 58.35 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 111.971 0.359 . . . . 60.12 111.971 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.732 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.11 17.34 21.39 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 112.676 0.621 . . . . 75.01 112.676 -176.155 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 70.3 mt -57.83 -44.44 99.41 Favored Pre-proline 0 CA--C 1.554 1.134 0 N-CA-C 113.673 0.99 . . . . 73.31 113.673 172.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -69.61 -15.97 37.93 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 121.931 1.754 . . . . 55.31 113.787 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.732 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 99.4 m-85 -92.03 -9.95 40.94 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.566 0.346 . . . . 72.22 111.616 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.533 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 65.7 mtt -85.28 162.77 18.98 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.294 0.569 . . . . 65.43 111.309 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.89 149.98 37.67 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 107.064 -1.458 . . . . 74.11 107.064 160.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.63 -25.13 66.07 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.081 0.771 . . . . 75.3 113.081 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -66.46 -48.53 69.63 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.69 0.618 . . . . 75.11 111.095 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 31.8 ttp -77.42 -24.29 50.44 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.501 -0.772 . . . . 75.51 111.155 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.437 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 57.4 ttt180 -63.52 -53.03 58.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.78 1.232 . . . . 75.13 111.878 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.696 0.398 . . . . 71.33 112.059 174.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.4 tp -61.94 -39.0 90.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 122.524 0.33 . . . . 70.03 110.707 172.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.402 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -66.3 -30.18 70.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.187 0.995 . . . . 50.4 112.329 177.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' A' ' 43' ' ' LYS . 14.2 tppt? -65.46 -39.47 92.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.347 -0.842 . . . . 70.1 110.453 175.286 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.403 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 20.8 mmt180 -71.06 -38.56 72.49 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.654 -0.703 . . . . 50.24 111.85 176.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.47 ' O ' HG13 ' A' ' 49' ' ' ILE . 33.3 m -67.86 -40.4 83.63 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.665 0.603 . . . . 74.2 111.647 -177.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.614 HD22 ' HG2' ' A' ' 24' ' ' MET . 21.4 mt -70.06 -28.76 65.71 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.949 0.351 . . . . 62.03 111.949 178.277 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.09 -25.57 62.67 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 123.423 0.452 . . . . 72.22 111.427 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 43.5 mmtm -73.72 -49.38 25.89 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 122.433 0.293 . . . . 71.53 111.327 176.363 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.514 HD11 HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -95.42 3.45 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 112.285 0.476 . . . . 75.2 112.285 -169.504 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.415 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . . . -52.64 -48.69 89.68 Favored Pre-proline 0 CA--C 1.556 1.206 0 N-CA-C 114.019 1.118 . . . . 72.55 114.019 171.011 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.415 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 2.8 Cg_exo -80.59 -3.81 12.63 Favored 'Trans proline' 0 C--N 1.379 2.157 0 CA-C-N 121.917 1.72 . . . . 74.54 113.977 173.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.463 ' HB2' HG22 ' A' ' 49' ' ' ILE . 77.5 mt -104.86 81.72 1.79 Allowed 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.086 0.469 . . . . 64.43 110.195 -177.142 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.854 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 2.7 t -87.13 87.68 7.51 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.165 0.802 . . . . 74.41 113.165 -173.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.436 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 17.0 mm-40 79.72 -66.15 0.17 Allowed 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.976 1.31 . . . . 75.02 113.395 162.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -70.91 -31.19 67.73 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.475 0.71 . . . . 73.42 110.242 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.417 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 1.8 mm-40 -76.52 -28.35 56.33 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.564 -0.744 . . . . 74.54 110.505 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -72.03 -25.54 61.85 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.496 0.718 . . . . 72.15 110.765 174.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.26 -20.69 61.49 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 111.969 0.359 . . . . 74.11 111.969 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.16 -41.61 84.17 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.189 0.519 . . . . 71.23 110.766 168.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.544 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.0 mt -85.93 -61.46 1.75 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.823 -1.08 . . . . 73.43 110.607 -171.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.17 35.34 19.6 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 124.902 1.376 . . . . 73.32 112.772 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp 64.39 104.9 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.948 1.299 . . . . 64.2 110.767 -172.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 13.2 m-85 -93.21 -60.97 1.66 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.729 -0.669 . . . . 71.42 111.675 177.09 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -87.27 80.12 8.33 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.865 0.84 . . . . 72.31 112.122 -171.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.101 -0.954 . . . . 43.41 110.657 177.581 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 77.6 mt . . . . . 0 N--CA 1.446 -0.651 0 N-CA-C 110.039 -0.356 . . . . 63.13 110.039 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.09 161.8 29.65 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.512 -0.551 . . . . 35.14 109.512 168.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.418 ' HA ' ' OG1' ' A' ' 9' ' ' THR . 13.5 mm -80.28 -9.26 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.275 0.56 . . . . 73.51 110.908 -175.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.09 -34.78 73.58 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.905 -0.497 . . . . 71.43 110.58 169.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.2 mm-40 -66.29 -49.14 68.09 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.756 0.66 . . . . 60.43 109.343 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.455 ' HB ' HG23 ' A' ' 62' ' ' ILE . 1.9 p -69.87 -26.89 64.41 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 123.943 0.777 . . . . 60.41 112.884 -177.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.31 -40.4 77.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.511 0.195 . . . . 71.24 111.056 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.1 tp -67.35 -38.94 85.62 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.225 0.61 . . . . 64.14 110.824 174.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 92.1 mt -65.71 -31.81 73.02 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.14 -0.937 . . . . 75.25 112.003 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -69.53 -32.26 70.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.369 0.668 . . . . 71.3 111.762 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 74.9 mt -68.77 -46.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 120.955 0.407 . . . . 73.21 110.283 178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -105.29 26.97 8.73 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.864 0.691 . . . . 74.41 112.864 -173.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.686 ' HA ' HD21 ' A' ' 23' ' ' LEU . 66.2 t30 -71.09 103.92 2.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.323 0.583 . . . . 71.52 111.263 -175.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -90.68 -22.7 21.02 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.646 -1.161 . . . . 74.0 109.892 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.03 -38.23 1.63 Allowed Glycine 0 C--N 1.336 0.555 0 C-N-CA 120.847 -0.692 . . . . 54.24 113.269 177.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.46 ' HA3' ' OE2' ' A' ' 54' ' ' GLU . . . -137.38 179.66 17.86 Favored Glycine 0 CA--C 1.504 -0.621 0 C-N-CA 121.174 -0.536 . . . . 54.24 111.967 -177.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.716 ' HD3' HG22 ' A' ' 49' ' ' ILE . 0.6 OUTLIER -77.59 -29.2 51.9 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 116.9 0.35 . . . . 74.13 110.904 -172.538 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -66.51 -47.84 71.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.835 0.71 . . . . 74.4 110.371 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.51 -32.88 82.97 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.637 -0.711 . . . . 64.35 113.265 176.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.686 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.1 mm? -67.72 -40.65 84.23 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.35 0.5 . . . . 44.41 112.35 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.404 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 96.0 mtp -69.36 -28.91 66.61 Favored 'General case' 0 C--O 1.219 -0.544 0 O-C-N 123.053 0.22 . . . . 73.11 111.582 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -73.43 -43.46 60.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.191 0.196 . . . . 54.14 111.359 173.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.17 -42.53 99.42 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 74.24 111.867 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.745 HG23 ' HB1' ' A' ' 42' ' ' ALA . 83.1 mt -71.82 -42.85 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.053 -0.521 . . . . 75.41 111.518 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 24' ' ' MET . 7.1 t-20 -62.62 -41.6 99.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.184 0.594 . . . . 74.5 111.96 -176.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.98 -34.6 50.83 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.91 -0.586 . . . . 74.21 112.049 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -97.18 18.03 15.88 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 113.242 0.83 . . . . 73.31 113.242 -171.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -54.02 -53.22 60.79 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 113.51 0.93 . . . . 44.21 113.51 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -76.24 -7.83 18.26 Favored 'Trans proline' 0 C--N 1.382 2.329 0 CA-C-N 121.18 1.457 . . . . 73.2 113.954 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.518 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 92.5 m-85 -90.01 -30.91 17.45 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 122.518 0.327 . . . . 72.54 111.769 -175.213 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.523 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 63.5 mtt -67.53 -75.78 0.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 122.969 0.508 . . . . 65.43 111.817 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.416 ' HB3' ' HB2' ' A' ' 38' ' ' MET . 18.7 t70 179.64 169.74 1.11 Allowed 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 104.96 -2.237 . . . . 44.12 104.96 -172.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.07 -40.04 47.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 119.04 0.836 . . . . 64.14 110.852 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.49 -41.7 72.33 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.225 0.536 . . . . 73.34 111.027 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.416 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 4.2 tpt -69.97 -26.84 64.29 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 114.96 -1.018 . . . . 72.51 111.22 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -69.14 -42.69 75.66 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.477 0.711 . . . . 74.44 111.552 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -65.0 -34.56 78.72 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.562 0.539 . . . . 71.13 111.116 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.6 tp -66.11 -48.99 69.08 Favored 'General case' 0 C--O 1.216 -0.694 0 O-C-N 123.888 0.743 . . . . 71.32 110.444 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.745 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -58.85 -41.01 85.97 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.628 1.171 . . . . 60.22 114.06 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -67.03 -34.89 78.69 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.337 0.398 . . . . 73.31 111.69 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -76.27 -34.23 59.14 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 74.01 111.443 178.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.458 HG22 HD11 ' A' ' 49' ' ' ILE . 7.5 m -65.85 -37.09 85.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.072 0.549 . . . . 61.14 110.741 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.74 -34.05 75.14 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.343 0.868 . . . . 74.01 113.343 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.18 -22.02 62.08 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.903 0.382 . . . . 55.21 111.62 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -88.5 -29.73 19.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.083 -0.508 . . . . 73.41 111.509 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.716 HG22 ' HD3' ' A' ' 20' ' ' LYS . 25.6 mt -91.95 -24.81 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 111.357 0.132 . . . . 65.42 111.357 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.02 -46.49 97.6 Favored Pre-proline 0 CA--C 1.557 1.213 0 N-CA-C 114.699 1.37 . . . . 73.53 114.699 177.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -80.31 3.89 7.28 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 121.64 1.56 . . . . 74.43 114.748 176.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.563 HD22 ' HG2' ' A' ' 56' ' ' GLU . 78.9 mt -88.79 169.14 11.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.444 -0.576 . . . . 74.12 109.444 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.5 p -103.58 174.27 5.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.376 -0.374 . . . . 73.51 110.314 173.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.46 ' OE2' ' HA3' ' A' ' 19' ' ' GLY . 54.4 tp10 -66.1 -36.51 83.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.886 -0.597 . . . . 74.43 110.565 175.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.484 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 52.0 m-80 -74.12 -32.68 63.29 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.828 -0.624 . . . . 65.2 111.859 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.563 ' HG2' HD22 ' A' ' 52' ' ' LEU . 8.0 tp10 -65.75 -37.03 85.25 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.805 0.442 . . . . 75.22 111.769 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.553 ' HB2' ' HB3' ' A' ' 20' ' ' LYS . 45.6 t80 -69.83 -32.95 71.65 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.4 -0.363 . . . . 53.33 110.654 176.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.25 -22.86 57.54 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.123 0.416 . . . . 63.21 112.123 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 13.9 mm-40 -68.0 -39.03 83.31 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.825 -0.435 . . . . 65.34 109.825 171.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.444 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 74.9 mt -71.58 -57.06 4.74 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 115.537 -0.756 . . . . 61.43 110.631 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 59.41 20.46 8.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.238 1.415 . . . . 73.15 112.788 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.455 HG23 ' HB ' ' A' ' 9' ' ' THR . 5.2 mp 56.63 88.37 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 124.767 1.227 . . . . 72.11 110.066 -167.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 55.5 m-85 -68.44 -42.04 79.44 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.44 -0.8 . . . . 73.23 111.344 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.401 ' HB3' HD12 ' A' ' 6' ' ' ILE . . . -122.21 106.8 11.46 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.774 -0.648 . . . . 51.44 111.926 -171.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.771 0 CA-C-N 115.679 -0.692 . . . . 63.23 109.946 169.689 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.548 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 76.1 mt . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 109.613 -0.514 . . . . 75.45 109.613 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 t -99.31 -174.49 2.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.916 -0.772 . . . . 72.22 108.916 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.466 ' H ' HD12 ' A' ' 6' ' ' ILE . 4.1 mp -63.85 -30.9 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.645 0.778 . . . . 71.02 112.324 -171.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -65.5 -47.17 76.91 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.642 0.377 . . . . 63.53 111.462 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.565 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 2.2 mp0 -68.38 -37.1 80.08 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.403 0.439 . . . . 65.42 111.542 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.4 m -73.73 -29.5 62.28 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 123.292 0.37 . . . . 55.25 111.478 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -69.55 -35.32 75.33 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.858 0.463 . . . . 70.21 110.461 173.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.501 HD21 ' HA ' ' A' ' 42' ' ' ALA . 14.3 tp -67.23 -40.24 86.34 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.164 -0.471 . . . . 72.02 110.813 174.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.634 ' HA ' HD11 ' A' ' 23' ' ' LEU . 88.5 mt -61.34 -38.95 88.78 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.763 0.665 . . . . 73.15 110.824 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 t -64.21 -34.01 77.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.114 0.966 . . . . 64.45 112.259 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 88.4 mt -74.29 -43.63 49.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 O-C-N 123.299 0.375 . . . . 64.24 111.228 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.492 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 78.9 m-85 -109.61 21.79 16.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.273 0.842 . . . . 75.01 113.273 -167.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.3 t30 -87.1 114.66 23.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.268 0.556 . . . . 74.52 111.361 -177.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.459 ' HB2' ' HA3' ' A' ' 22' ' ' GLY . 28.0 mm-40 -97.82 6.12 48.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.369 -0.832 . . . . 65.03 111.624 176.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.51 51.8 1.18 Allowed Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.914 -0.874 . . . . 61.13 110.914 -175.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.55 167.47 11.72 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.826 -0.509 . . . . 64.2 111.826 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.39 -18.12 57.59 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 111.918 0.34 . . . . 72.23 111.918 -176.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.472 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 48.0 ttm-85 -64.72 -44.1 91.29 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.514 -0.766 . . . . 62.53 109.776 176.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.459 ' HA3' ' HB2' ' A' ' 17' ' ' GLU . . . -61.22 -31.61 77.6 Favored Glycine 0 C--N 1.341 0.838 0 O-C-N 124.014 0.821 . . . . 62.41 113.612 174.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.634 HD11 ' HA ' ' A' ' 12' ' ' LEU . 3.9 mm? -65.81 -43.63 88.09 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 122.548 0.339 . . . . 73.31 111.703 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 54.4 mtt -73.64 -35.4 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.156 0.428 . . . . 75.21 112.156 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 47.1 mm-40 -65.54 -50.35 65.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.647 0.261 . . . . 65.05 111.41 175.105 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.492 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.4 m-80 -69.71 -42.48 73.98 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.167 0.802 . . . . 63.35 113.167 -174.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.544 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 54.9 mt -68.73 -48.53 70.78 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.591 0 CA-C-O 118.84 -0.6 . . . . 74.33 111.763 -178.58 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -66.63 -30.19 70.41 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.361 0.875 . . . . 72.31 113.361 -175.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.29 -37.86 25.21 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.679 0.251 . . . . 31.14 111.679 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.704 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.43 19.09 15.06 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.579 0.585 . . . . 73.14 112.579 -174.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 51.6 mt -56.32 -51.99 76.61 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-O 118.12 -0.943 . . . . 62.34 112.48 173.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.5 -15.53 45.33 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.025 1.817 . . . . 71.52 114.027 174.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.704 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.7 m-85 -90.88 -5.01 56.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.941 0.496 . . . . 64.14 111.267 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 60.3 mtt -84.2 171.73 12.53 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.019 -0.363 . . . . 64.52 110.019 173.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -77.34 0.14 Allowed 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.384 -0.371 . . . . 70.33 111.216 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -175.94 -47.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.11 0.964 . . . . 60.21 108.779 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.6 -42.41 82.49 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.11 -0.95 . . . . 64.34 109.912 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 2.0 tpt -71.65 -27.04 62.81 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.574 -0.739 . . . . 64.15 111.572 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 39' ' ' ARG . 42.2 ttm180 -74.98 -46.58 34.37 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.022 0.529 . . . . 75.22 111.591 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -62.89 -34.41 77.36 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.069 0.461 . . . . 73.02 111.471 175.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 tp -66.72 -41.63 87.62 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.224 -0.898 . . . . 71.41 110.902 175.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.501 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -63.64 -38.11 89.88 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.456 0.909 . . . . 72.15 113.456 -175.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -64.12 -42.91 96.66 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 123.636 0.585 . . . . 64.31 111.178 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -73.02 -34.6 66.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.709 -0.678 . . . . 74.3 112.334 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.423 ' O ' HG13 ' A' ' 49' ' ' ILE . 35.0 m -71.34 -41.39 69.88 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.599 -0.273 . . . . 73.11 110.971 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.2 mt -65.36 -29.38 70.1 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.656 0.613 . . . . 62.53 112.656 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.08 -19.74 62.43 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.156 0.428 . . . . 51.43 112.156 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -29.21 22.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.316 0.246 . . . . 65.22 111.609 176.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 45' ' ' THR . 4.2 mt -90.17 -14.79 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-O 120.851 0.358 . . . . 65.01 110.683 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -47.02 99.41 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 114.013 1.116 . . . . 72.33 114.013 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -75.58 7.05 3.26 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 121.675 1.583 . . . . 64.24 114.484 172.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.3 mt -106.19 174.26 5.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.886 0.374 . . . . 52.1 110.517 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.6 p -112.01 -168.11 1.27 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.69 -0.856 . . . . 72.51 108.69 167.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.36 -7.8 57.35 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.534 -0.173 . . . . 70.21 110.534 175.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -72.93 -47.73 43.14 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.703 -0.48 . . . . 73.0 109.703 170.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -71.27 -29.43 65.06 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.534 . . . . 64.34 111.701 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -69.42 -36.92 77.16 Favored 'General case' 0 C--O 1.217 -0.629 0 O-C-N 123.278 0.361 . . . . 74.34 110.597 174.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.16 -17.48 60.91 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.031 0.382 . . . . 72.41 112.031 -177.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -66.76 -37.29 84.33 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.117 -0.492 . . . . 74.23 110.826 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.551 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 43.2 mt -83.26 -59.65 2.4 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.72 -0.673 . . . . 71.04 110.799 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.87 -107.22 0.35 Allowed 'General case' 0 C--N 1.344 0.361 0 O-C-N 125.251 1.594 . . . . 44.43 110.67 -171.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 31.2 mm -126.1 98.64 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.674 -0.862 . . . . 73.05 108.674 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.551 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 4.7 m-85 -91.87 -85.94 0.24 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.172 -0.467 . . . . 71.11 111.927 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' ILE . . . -96.5 82.83 3.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.264 0.554 . . . . 75.2 110.99 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.591 0 CA-C-N 115.577 -0.738 . . . . 65.41 110.124 173.591 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 N--CA 1.443 -0.818 0 N-CA-C 108.624 -0.88 . . . . 73.33 108.624 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -74.01 156.94 37.0 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.584 -0.735 . . . . 73.21 109.519 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mm -64.24 -32.85 59.13 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 122.64 0.376 . . . . 72.05 111.142 -177.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -69.7 -34.66 74.21 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.14 -0.482 . . . . 74.11 111.211 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 39.0 mt-10 -69.71 -41.82 74.86 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.584 0.553 . . . . 73.33 111.199 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.5 ' HA ' HD12 ' A' ' 12' ' ' LEU . 2.3 m -75.35 -24.89 57.38 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.482 0.489 . . . . 65.13 111.506 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.46 -36.74 81.75 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.259 -0.276 . . . . 73.02 110.863 169.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.549 HD13 ' HG2' ' A' ' 38' ' ' MET . 46.2 tp -64.66 -36.52 84.53 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.069 0.548 . . . . 64.3 110.074 173.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.776 ' HA ' HD11 ' A' ' 23' ' ' LEU . 81.7 mt -67.11 -39.64 86.71 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.259 -0.882 . . . . 73.42 111.091 173.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.408 ' HA ' HD12 ' A' ' 62' ' ' ILE . 22.8 t -69.41 -26.16 64.49 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.964 0.906 . . . . 75.52 112.919 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 73.8 mt -79.38 -35.23 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 122.277 0.231 . . . . 52.43 110.622 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -114.96 24.64 11.55 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.913 0.709 . . . . 74.23 112.913 -173.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 64.4 t30 -85.26 90.48 7.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.384 0.611 . . . . 54.23 110.112 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -114.67 -25.22 8.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.922 -1.035 . . . . 73.1 111.275 -176.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -169.87 64.86 0.17 Allowed Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.004 -1.093 . . . . 32.2 113.489 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.16 -155.49 47.67 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 111.608 -0.597 . . . . 65.53 111.608 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.494 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 2.6 pptp? -83.51 -11.71 57.12 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.211 0.505 . . . . 75.11 110.324 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 ttp85 -68.35 -53.27 25.21 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.194 -0.669 . . . . 74.31 109.194 170.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.9 -32.93 76.44 Favored Glycine 0 C--N 1.342 0.898 0 O-C-N 124.392 1.058 . . . . 60.13 113.442 173.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.776 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.6 mm? -68.14 -49.71 59.29 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 117.11 0.455 . . . . 61.42 112.196 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.507 ' HG2' HD22 ' A' ' 46' ' ' LEU . 50.7 mtt -66.72 -34.16 77.23 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.518 0.562 . . . . 71.52 112.518 -176.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -70.07 -51.22 33.7 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.33 0.252 . . . . 75.41 111.556 175.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -76.66 -29.25 56.3 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.997 0.74 . . . . 72.41 112.997 -170.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.464 HD11 HD12 ' A' ' 23' ' ' LEU . 60.6 mt -69.04 -50.45 53.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 117.88 0.309 . . . . 75.15 110.447 175.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -67.61 -33.33 74.78 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.113 0.783 . . . . 61.42 113.113 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.99 -33.48 61.86 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.776 0.322 . . . . 73.4 111.637 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.718 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.15 19.52 19.41 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.542 0.571 . . . . 71.41 112.542 -176.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.445 HD23 ' HE3' ' A' ' 34' ' ' MET . 61.1 mt -56.4 -50.12 89.47 Favored Pre-proline 0 CA--C 1.55 0.947 0 CA-C-O 118.266 -0.873 . . . . 74.11 112.502 171.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.99 -23.6 53.87 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 121.656 1.57 . . . . 73.33 113.923 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.718 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.0 m-85 -77.78 -36.46 50.43 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.803 0.441 . . . . 60.5 111.628 -177.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.445 ' HE3' HD23 ' A' ' 31' ' ' LEU . 22.3 ptp -82.21 168.81 17.28 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.714 0.292 . . . . 62.33 110.787 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -72.28 154.27 41.07 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.872 -0.603 . . . . 63.32 109.521 176.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 39' ' ' ARG . 29.1 tt0 -70.44 -20.19 62.92 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.673 0.619 . . . . 61.41 112.673 -175.038 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -65.77 -44.8 84.73 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.006 0.431 . . . . 72.33 110.415 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.549 ' HG2' HD13 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -76.27 -25.16 54.67 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.034 -0.985 . . . . 74.12 111.009 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.439 ' HB3' ' HA ' ' A' ' 36' ' ' GLU . 35.8 ttm180 -71.86 -44.71 63.34 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.3 1.04 . . . . 72.13 111.471 -179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -71.26 -29.95 65.71 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.742 0.417 . . . . 74.1 111.462 174.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -61.57 -34.05 74.92 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.201 -0.909 . . . . 75.35 111.381 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.48 75.89 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.548 0.944 . . . . 62.13 113.548 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.07 -38.8 92.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 73.14 110.434 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 44' ' ' ARG . 39.3 mtt180 -71.32 -53.53 13.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.959 -1.019 . . . . 54.14 112.213 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.8 m -61.41 -44.97 96.21 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.651 0.78 . . . . 70.15 112.733 -172.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.507 HD22 ' HG2' ' A' ' 24' ' ' MET . 96.3 mt -64.94 -27.43 68.84 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.783 0.661 . . . . 65.01 112.783 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.4 64.43 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.857 0.688 . . . . 73.43 112.857 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.32 -27.6 29.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.693 0.224 . . . . 60.13 110.997 177.429 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.446 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.0 mt -97.17 -12.09 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-O 121.041 0.448 . . . . 73.4 110.904 -173.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.12 97.57 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 114.341 1.237 . . . . 73.13 114.341 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -79.51 11.23 2.75 Favored 'Trans proline' 0 C--N 1.383 2.361 0 CA-C-N 122.152 1.804 . . . . 73.43 114.307 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 49' ' ' ILE . 95.8 mt -108.29 -179.66 3.95 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 122.762 0.425 . . . . 63.35 110.118 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.457 HG23 ' OD1' ' A' ' 55' ' ' ASN . 6.4 t -139.11 -169.95 2.77 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.471 -0.937 . . . . 73.45 108.471 174.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -64.79 -43.39 93.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.53 0.732 . . . . 71.34 112.7 -167.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.457 ' OD1' HG23 ' A' ' 53' ' ' THR . 30.7 p-10 -67.78 -32.45 73.03 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.678 0.612 . . . . 72.43 112.285 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -67.17 -41.64 85.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 123.733 0.646 . . . . 71.33 111.844 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.593 ' HE1' HD13 ' A' ' 12' ' ' LEU . 88.5 t80 -75.29 -38.46 60.36 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.477 0.486 . . . . 75.42 111.467 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.81 -24.04 66.83 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.807 1.04 . . . . 71.45 113.807 -168.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.08 -34.08 43.92 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.584 0.216 . . . . 73.3 111.584 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 mt -75.85 -56.38 4.73 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.238 -0.653 . . . . 73.05 109.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.58 -108.52 0.42 Allowed 'General case' 0 C--N 1.346 0.425 0 O-C-N 125.498 1.749 . . . . 73.21 113.17 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.408 HD12 ' HA ' ' A' ' 13' ' ' SER . 17.1 mm -113.2 88.31 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.072 -1.085 . . . . 55.02 108.072 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -103.64 -10.64 18.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.48 -0.782 . . . . 71.41 112.01 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -146.44 82.04 1.58 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 51.51 111.339 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.622 0 CA-C-N 115.552 -0.749 . . . . 64.04 109.192 170.128 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.597 HD21 ' HG3' ' A' ' 48' ' ' LYS . 85.7 mt . . . . . 0 CA--C 1.51 -0.561 0 CA-C-O 121.13 0.491 . . . . 72.3 111.527 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' HG2' ' A' ' 8' ' ' GLU . 14.9 t -90.3 166.78 13.13 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.389 -0.823 . . . . 55.52 109.004 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.3 mm -69.41 -27.35 33.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 116.228 -0.442 . . . . 64.23 110.715 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.54 -45.59 78.9 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.592 0.757 . . . . 71.21 112.378 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.479 ' HG2' HG22 ' A' ' 5' ' ' THR . 43.0 mm-40 -64.29 -43.91 93.27 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.556 0.535 . . . . 65.52 110.362 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.69 ' HA ' HD12 ' A' ' 12' ' ' LEU . 3.1 m -73.46 -26.54 60.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.777 -1.101 . . . . 61.21 111.325 -176.647 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.437 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.8 t-20 -69.44 -36.51 76.71 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.005 0.522 . . . . 73.14 111.45 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.623 HD12 HD12 ' A' ' 14' ' ' ILE . 38.0 tp -74.01 -33.17 63.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.879 0.371 . . . . 72.53 110.538 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.69 HD12 ' HA ' ' A' ' 9' ' ' THR . 69.4 mt -63.53 -35.32 80.07 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-N 115.634 -0.712 . . . . 74.53 110.622 170.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -70.68 -24.55 62.7 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.526 0.73 . . . . 74.23 111.988 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.623 HD12 HD12 ' A' ' 11' ' ' LEU . 96.6 mt -69.93 -34.38 59.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 123.006 0.522 . . . . 43.31 110.266 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -107.39 -84.95 0.52 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.26 -0.4 . . . . 70.53 111.309 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.606 ' HA ' HD21 ' A' ' 23' ' ' LEU . 64.3 t30 57.13 83.83 0.1 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.389 1.476 . . . . 62.0 111.829 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.478 ' H ' HD22 ' A' ' 23' ' ' LEU . 38.5 tt0 -149.53 123.63 9.46 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.763 -1.108 . . . . 72.41 110.03 -177.036 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.17 24.02 74.53 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 115.535 0.974 . . . . 71.42 115.535 167.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.92 -150.19 42.35 Favored Glycine 0 C--O 1.221 -0.695 0 C-N-CA 121.153 -0.546 . . . . 71.1 112.497 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 57' ' ' TYR . 14.2 tmtt? -64.97 -43.35 92.94 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.95 0.5 . . . . 73.13 111.085 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -72.81 -45.4 58.68 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.051 -0.977 . . . . 74.33 111.318 -172.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.38 -30.08 74.89 Favored Glycine 0 CA--C 1.524 0.627 0 O-C-N 123.757 0.661 . . . . 75.02 113.137 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' A' ' 16' ' ' ASN . 0.5 OUTLIER -64.24 -37.89 89.09 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.821 0.31 . . . . 71.42 110.905 173.664 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.654 ' HG2' HD22 ' A' ' 46' ' ' LEU . 37.8 mtt -69.42 -39.41 77.88 Favored 'General case' 0 C--O 1.221 -0.415 0 O-C-N 123.234 0.334 . . . . 74.32 111.505 175.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -63.71 -40.81 97.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.693 0.397 . . . . 61.53 111.723 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -77.98 -42.68 32.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.712 -0.676 . . . . 71.25 111.174 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.0 mt -72.63 -38.48 58.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 119.107 -0.473 . . . . 74.22 111.868 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -63.36 -35.76 81.47 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.254 0.479 . . . . 63.52 111.693 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -19.26 61.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.109 -0.496 . . . . 54.41 112.307 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.651 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -113.79 17.29 18.17 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.415 0.524 . . . . 52.14 112.415 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.51 -44.65 56.55 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 113.441 0.904 . . . . 75.22 113.441 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.26 7.95 2.74 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 121.709 1.606 . . . . 55.14 114.122 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.651 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 95.9 m-85 -114.29 -168.8 1.41 Allowed 'General case' 0 C--O 1.242 0.681 0 C-N-CA 123.12 0.568 . . . . 65.45 109.618 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 68.0 mtm 68.16 -88.81 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.309 1.444 . . . . 75.14 111.454 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -167.85 164.1 14.05 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 106.832 -1.544 . . . . 75.02 106.832 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.64 -31.71 71.91 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.043 0.383 . . . . 61.45 111.734 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.34 -39.01 55.06 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.0 0.52 . . . . 64.02 110.508 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 5.7 mtt -68.03 -28.51 67.46 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 115.914 -0.585 . . . . 54.25 111.882 174.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -71.04 -43.02 68.72 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 123.311 0.645 . . . . 62.21 111.156 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -67.98 -32.17 72.38 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 111.562 0.208 . . . . 73.23 111.562 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.72 -48.07 78.56 Favored 'General case' 0 C--O 1.213 -0.846 0 O-C-N 123.644 0.59 . . . . 72.44 109.653 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.63 -34.76 76.24 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.348 1.059 . . . . 53.13 113.537 -177.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -66.27 -35.97 81.79 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 123.688 0.617 . . . . 75.42 111.813 177.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -79.75 -28.98 40.38 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.468 0.48 . . . . 74.03 111.515 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 m -75.35 -30.66 60.31 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.945 0.402 . . . . 75.43 110.39 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.654 HD22 ' HG2' ' A' ' 24' ' ' MET . 67.6 mt -76.71 -31.16 57.02 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.182 0.438 . . . . 70.25 112.182 169.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.42 -33.12 73.65 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.743 0.645 . . . . 74.45 112.743 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.597 ' HG3' HD21 ' A' ' 4' ' ' LEU . 0.1 OUTLIER -86.4 -17.21 34.95 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.914 0.339 . . . . 71.31 111.914 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.53 HG22 HD12 ' A' ' 52' ' ' LEU . 31.7 pt -97.82 -8.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 120.415 -0.514 . . . . 64.4 112.005 174.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.66 -46.32 99.59 Favored Pre-proline 0 CA--C 1.557 1.216 0 CA-C-O 118.261 -0.876 . . . . 61.34 113.208 171.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.45 -5.91 15.92 Favored 'Trans proline' 0 C--N 1.381 2.266 0 CA-C-N 121.62 1.614 . . . . 65.12 114.139 171.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.53 HD12 HG22 ' A' ' 49' ' ' ILE . 76.7 mt -92.17 153.07 19.55 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.886 0.374 . . . . 61.42 110.115 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 p -95.01 -176.89 3.97 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.982 175.222 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.56 -30.28 69.87 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.902 -0.59 . . . . 75.55 111.362 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -71.72 -39.4 70.16 Favored 'General case' 0 C--O 1.226 -0.183 0 O-C-N 123.724 0.64 . . . . 72.04 110.527 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.3 -42.04 93.48 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 123.716 0.635 . . . . 64.53 112.711 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.486 ' HB3' ' HB2' ' A' ' 20' ' ' LYS . 80.1 t80 -75.58 -26.15 57.65 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.052 0.22 . . . . 73.12 111.218 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.96 -29.04 66.06 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.94 0.336 . . . . 70.5 111.341 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.38 -23.44 61.11 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 123.456 0.472 . . . . 75.32 111.811 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -93.75 -69.06 0.77 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.639 0.376 . . . . 71.31 111.808 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.94 -135.02 1.46 Allowed 'General case' 0 C--N 1.352 0.709 0 C-N-CA 124.741 1.216 . . . . 72.24 110.709 -172.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.4 mm -97.1 98.0 6.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.002 -1.111 . . . . 74.52 108.002 172.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -117.45 -9.6 10.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.334 -0.848 . . . . 71.22 111.794 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.94 -29.04 3.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.462 0.542 . . . . 74.14 112.462 -173.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.515 0 N-CA-C 112.901 0.704 . . . . 73.13 112.901 -174.469 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.8 mt . . . . . 0 CA--C 1.516 -0.363 0 CA-C-O 120.604 0.24 . . . . 35.33 110.401 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.8 p -87.33 169.8 11.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.163 -0.471 . . . . 63.25 110.836 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.404 HG12 ' HB1' ' A' ' 64' ' ' ALA . 50.5 mt -70.8 -22.49 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.743 -0.662 . . . . 71.43 109.803 177.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.42 -55.04 27.54 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.136 0.575 . . . . 74.33 111.22 174.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.01 -37.33 69.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.675 -0.693 . . . . 72.32 111.912 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.74 ' HA ' HD12 ' A' ' 12' ' ' LEU . 7.6 m -74.75 -27.82 60.51 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.402 -0.363 . . . . 64.3 111.89 -179.167 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -65.25 -38.22 89.66 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 122.198 -0.314 . . . . 74.04 110.524 174.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.531 ' HA ' HD12 ' A' ' 14' ' ' ILE . 21.3 tp -70.65 -32.55 69.88 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.619 0.574 . . . . 63.3 111.023 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 9' ' ' THR . 86.9 mt -61.91 -40.92 97.12 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.868 -0.605 . . . . 61.54 111.178 171.013 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 t -71.5 -27.55 63.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.312 0.645 . . . . 64.4 112.093 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 11' ' ' LEU . 75.6 mt -63.79 -37.5 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.395 0.678 . . . . 73.12 111.116 176.029 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -94.88 -87.75 0.26 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 119.584 -0.246 . . . . 74.54 110.449 175.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.421 ' HA ' HD21 ' A' ' 23' ' ' LEU . 58.2 t30 50.28 66.46 1.14 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.809 1.244 . . . . 73.32 111.798 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -85.49 -75.87 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.564 -0.744 . . . . 72.43 110.806 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -141.8 66.62 0.48 Allowed Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 111.437 -0.665 . . . . 33.12 111.437 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.68 -160.11 37.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.411 -0.424 . . . . 74.22 112.117 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.629 ' HE2' HG22 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -70.4 -29.4 66.01 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.567 0.58 . . . . 72.12 112.567 -174.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.9 mtt180 -71.5 -44.78 64.06 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 123.165 0.291 . . . . 54.4 110.434 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.69 -27.34 68.11 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 123.552 0.533 . . . . 71.13 112.828 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' A' ' 23' ' ' LEU . 1.2 mm? -71.41 -56.44 5.95 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-O 119.403 -0.332 . . . . 70.21 111.884 172.683 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 97.6 mtp -72.2 -35.99 69.09 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.574 0.583 . . . . 61.41 112.574 -169.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.3 -45.67 86.96 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.121 0.568 . . . . 63.32 112.202 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -78.36 -24.44 46.45 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.166 0.432 . . . . 65.43 112.166 -177.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.782 HG23 ' HB1' ' A' ' 42' ' ' ALA . 20.8 mt -67.01 -46.52 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 119.59 -0.243 . . . . 73.31 110.648 173.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -66.2 -33.73 76.43 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.501 0.556 . . . . 70.11 112.501 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.01 -36.17 59.25 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 123.458 0.473 . . . . 61.12 112.145 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.722 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.28 21.07 18.06 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.966 0.728 . . . . 74.01 112.966 -172.138 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HB2' ' HD3' ' A' ' 32' ' ' PRO . 79.1 mt -52.27 -53.21 55.17 Favored Pre-proline 0 CA--C 1.56 1.347 0 N-CA-C 113.402 0.889 . . . . 74.34 113.402 173.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.481 ' HD3' ' HB2' ' A' ' 31' ' ' LEU . 7.3 Cg_exo -76.33 -13.14 18.84 Favored 'Trans proline' 0 C--N 1.381 2.255 0 C-N-CA 121.982 1.788 . . . . 75.53 113.681 177.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.722 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.8 m-85 -81.49 -21.98 38.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.86 0.362 . . . . 62.52 110.742 177.475 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.0 mtm -84.52 163.82 19.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.863 -0.608 . . . . 63.54 110.63 171.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -85.37 177.78 7.68 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.83 -0.623 . . . . 73.11 110.518 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -42.71 -52.1 5.05 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 126.232 1.813 . . . . 75.44 114.078 -176.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -68.55 -50.59 50.71 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.301 0.64 . . . . 74.15 111.441 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 62.6 mtt -70.46 -27.43 64.23 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 124.006 0.816 . . . . 35.21 112.769 -172.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -65.84 -50.88 63.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.526 0.73 . . . . 73.43 111.12 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.16 -32.4 63.11 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.801 0.667 . . . . 72.55 112.801 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -69.17 -28.73 66.67 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.164 0.585 . . . . 75.25 110.777 178.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.782 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -66.12 -36.23 82.61 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 112.655 0.613 . . . . 64.53 112.655 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.86 -33.07 74.04 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 123.398 0.436 . . . . 74.14 111.591 176.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.423 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 79.4 mtp180 -68.32 -39.12 82.1 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.646 -0.706 . . . . 75.32 110.81 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 49' ' ' ILE . 6.9 m -73.65 -35.06 65.22 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.745 -0.661 . . . . 70.03 111.064 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 79.3 mt -62.47 -38.14 88.67 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.566 0.346 . . . . 73.2 111.534 173.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.61 -15.32 62.74 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.338 -0.847 . . . . 44.32 112.43 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 46.5 mmtm -88.36 -42.03 12.46 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.505 0.558 . . . . 62.24 112.505 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.629 HG22 ' HE2' ' A' ' 20' ' ' LYS . 6.5 mt -83.26 -25.26 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 117.838 0.29 . . . . 65.3 111.736 -172.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.1 -45.84 73.01 Favored Pre-proline 0 CA--C 1.552 1.019 0 N-CA-C 113.801 1.037 . . . . 75.31 113.801 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -76.0 -6.26 17.19 Favored 'Trans proline' 0 C--N 1.376 2.011 0 CA-C-N 122.194 1.819 . . . . 71.24 114.212 174.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.3 mt -90.96 162.38 14.77 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.033 0.444 . . . . 74.23 109.986 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.427 HG22 ' HG3' ' A' ' 56' ' ' GLU . 14.5 t -93.33 174.64 7.11 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 109.495 -0.558 . . . . 55.23 109.495 170.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.517 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 12.8 pt-20 -68.2 -26.89 65.96 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.202 0.601 . . . . 72.4 112.173 -179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -74.34 -40.53 62.11 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 122.242 0.217 . . . . 73.22 110.863 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.427 ' HG3' HG22 ' A' ' 53' ' ' THR . 48.8 mt-10 -66.67 -37.23 84.35 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.46 0.475 . . . . 52.45 112.254 -177.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -70.11 -36.26 74.71 Favored 'General case' 0 C--O 1.217 -0.653 0 O-C-N 123.299 0.374 . . . . 73.24 110.742 175.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.99 -24.99 60.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.27 0.471 . . . . 74.44 112.27 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.15 -29.99 64.58 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.364 0.265 . . . . 74.42 111.17 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.2 mt -84.86 -43.57 14.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.126 -0.488 . . . . 70.12 110.231 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.85 -110.37 0.56 Allowed 'General case' 0 C--N 1.347 0.491 0 O-C-N 125.341 1.651 . . . . 73.1 110.994 -173.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 46.6 mm -110.93 94.95 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 106.926 -1.509 . . . . 63.2 106.926 168.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -80.32 -62.59 1.63 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.33 -1.305 . . . . 73.32 111.547 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.604 ' H ' HG21 ' A' ' 9' ' ' THR . . . -126.2 86.27 2.5 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.149 0.5 . . . . 75.31 111.438 -178.174 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 73.04 111.109 176.893 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 C--O 1.233 0.219 0 CA-C-O 120.643 0.259 . . . . 71.51 110.65 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.01 171.38 8.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 116.068 -0.515 . . . . 64.24 110.37 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.557 ' HA ' ' HB1' ' A' ' 64' ' ' ALA . 17.0 mm -57.84 -47.15 86.86 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.627 0 C-N-CA 123.78 0.832 . . . . 72.55 111.517 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -60.21 -36.04 76.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.567 0.747 . . . . 62.24 112.64 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.576 ' HG2' HD11 ' A' ' 41' ' ' LEU . 32.7 mt-10 -75.17 -41.09 58.85 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.933 0.493 . . . . 72.15 111.495 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.424 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.8 m -76.64 -28.0 55.87 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 116.18 -0.464 . . . . 62.21 111.639 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -71.63 -26.21 62.47 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.097 0.559 . . . . 72.34 111.267 173.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.532 HD21 ' HA ' ' A' ' 42' ' ' ALA . 50.6 tp -66.21 -31.01 71.58 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 122.628 0.371 . . . . 74.05 111.204 173.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.511 HD22 HD21 ' A' ' 23' ' ' LEU . 83.7 mt -60.36 -32.5 71.34 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.248 -0.433 . . . . 33.22 111.355 173.417 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -69.47 -25.58 64.15 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.286 0.635 . . . . 72.2 112.329 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.9 mm -69.18 -44.96 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 122.899 0.48 . . . . 73.13 111.125 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.426 ' HB2' HD12 ' A' ' 23' ' ' LEU . 82.9 m-85 -120.23 19.29 12.2 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.982 0.734 . . . . 71.12 112.982 -172.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -67.88 106.98 2.47 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.077 0.465 . . . . 64.23 109.999 178.716 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -145.07 96.38 2.84 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.894 -1.048 . . . . 75.44 108.279 -178.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.46 42.68 32.98 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 120.697 -0.763 . . . . 55.55 111.901 -173.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.52 -138.46 21.72 Favored Glycine 0 N--CA 1.447 -0.589 0 O-C-N 123.833 0.373 . . . . 63.22 112.474 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.741 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 2.2 pptp? -95.72 -7.96 35.88 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.796 0.351 . . . . 74.55 111.253 -177.535 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -63.92 -60.28 3.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.801 -0.636 . . . . 73.51 110.318 174.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -27.93 71.58 Favored Glycine 0 C--O 1.223 -0.579 0 CA-C-N 115.702 -0.681 . . . . 63.41 112.747 176.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.741 ' HB3' ' HA ' ' A' ' 20' ' ' LYS . 57.3 tp -59.98 -44.35 94.55 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.397 0.679 . . . . 73.33 111.406 175.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 46.5 mtt -64.16 -46.99 81.6 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.232 0.456 . . . . 42.13 112.232 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -63.79 -41.68 97.89 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 123.762 0.664 . . . . 74.22 111.339 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.415 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 20.5 m-80 -71.83 -38.05 70.23 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 112.508 0.559 . . . . 72.42 112.508 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.5 mt -70.04 -44.52 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 119.301 -0.38 . . . . 72.15 111.563 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -65.65 -35.58 81.21 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.283 0.475 . . . . 54.14 112.283 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.48 -29.99 64.13 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 123.207 0.317 . . . . 75.54 111.578 177.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.75 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -99.98 16.41 24.01 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.519 0.563 . . . . 62.44 112.519 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.2 mt -67.28 -44.81 48.9 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.618 -0.706 . . . . 53.14 112.065 172.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.8 12.61 0.69 Allowed 'Trans proline' 0 C--N 1.377 2.065 0 CA-C-N 121.759 1.664 . . . . 35.01 113.911 169.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.75 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.4 m-85 -124.47 -154.92 0.64 Allowed 'General case' 0 C--O 1.239 0.517 0 C-N-CA 123.72 0.808 . . . . 73.55 109.222 177.117 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 70.8 mtm 67.47 -94.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.297 1.439 . . . . 74.3 112.796 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -174.74 147.58 1.04 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.479 -1.675 . . . . 72.12 106.479 -166.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.04 -38.32 79.09 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 118.403 0.547 . . . . 72.42 112.168 -177.168 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.76 -45.25 75.44 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.18 0.514 . . . . 74.02 110.705 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 18.4 ttp -73.04 -24.34 60.7 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.302 -0.863 . . . . 64.21 111.844 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -69.22 -39.73 78.4 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.839 0.456 . . . . 60.54 111.626 173.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -61.72 -36.34 80.66 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.062 0.458 . . . . 75.11 111.188 173.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.576 HD11 ' HG2' ' A' ' 8' ' ' GLU . 27.2 tp -71.36 -39.06 71.49 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 115.285 -0.87 . . . . 72.31 111.04 176.215 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.532 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -66.41 -32.35 73.68 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.252 0.621 . . . . 70.24 112.322 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -65.39 -44.82 86.32 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.199 -0.91 . . . . 74.42 111.992 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -80.34 -22.11 41.79 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.88 0.696 . . . . 74.31 112.88 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.508 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 60.7 m -84.24 -27.29 28.03 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 120.816 0.341 . . . . 72.32 110.868 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.422 HD23 HD11 ' A' ' 49' ' ' ILE . 28.9 mt -66.99 -33.73 76.22 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 122.101 -0.375 . . . . 73.31 111.709 168.131 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.52 -20.53 60.63 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 123.584 0.553 . . . . 44.53 112.239 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -87.18 -25.76 23.89 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 119.484 -0.293 . . . . 63.23 111.6 178.624 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.473 HG22 HD12 ' A' ' 52' ' ' LEU . 15.4 pt -92.66 -14.76 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 112.395 0.517 . . . . 74.41 112.395 178.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.19 -48.01 97.71 Favored Pre-proline 0 CA--C 1.554 1.133 0 N-CA-C 114.639 1.348 . . . . 74.21 114.639 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.98 -1.32 11.15 Favored 'Trans proline' 0 C--N 1.38 2.215 0 CA-C-N 121.96 1.736 . . . . 62.34 113.98 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.473 HD12 HG22 ' A' ' 49' ' ' ILE . 61.4 mt -86.83 149.11 25.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.202 -0.666 . . . . 72.15 109.202 177.174 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 t -95.02 178.23 5.62 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 108.954 -0.758 . . . . 75.24 108.954 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -74.19 -38.79 63.53 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.746 0.308 . . . . 73.15 111.553 -172.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -72.08 -29.57 64.25 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.042 -0.526 . . . . 73.02 111.021 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -71.64 -30.94 66.31 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.208 0.603 . . . . 73.0 111.18 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -74.53 -28.22 60.87 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 110.159 -0.311 . . . . 72.52 110.159 173.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.1 -22.22 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.967 0.349 . . . . 71.05 111.7 177.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -71.23 -37.57 72.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.938 -0.574 . . . . 71.21 111.688 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.43 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 13.2 mt -85.31 -53.01 5.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.142 -0.481 . . . . 74.11 110.759 -176.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.53 -109.17 0.47 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.742 1.617 . . . . 53.23 111.136 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 47.3 mm -121.55 107.39 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 107.779 -1.193 . . . . 75.32 107.779 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.43 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 1.2 m-85 -97.03 -73.7 0.59 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.229 -0.441 . . . . 74.54 111.775 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.557 ' HB1' ' HA ' ' A' ' 6' ' ' ILE . . . -89.98 102.14 14.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.304 0.573 . . . . 62.41 111.111 -175.279 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.139 -0.937 . . . . 71.43 108.966 178.332 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.477 HD11 ' HD2' ' A' ' 48' ' ' LYS . 19.0 mt . . . . . 0 C--O 1.239 0.541 0 N-CA-C 109.166 -0.679 . . . . 52.23 109.166 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -82.64 172.6 12.76 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 109.356 -0.609 . . . . 55.2 109.356 176.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.8 mm -69.65 -22.31 25.07 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.557 -0.747 . . . . 73.22 111.01 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.31 -40.21 85.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.632 0.373 . . . . 72.4 111.689 175.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -65.91 -40.84 91.85 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.271 0.357 . . . . 74.31 111.213 175.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.492 HG21 ' H ' ' A' ' 64' ' ' ALA . 6.4 m -70.14 -34.77 73.46 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.958 -0.564 . . . . 70.51 111.467 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.485 ' O ' HG13 ' A' ' 14' ' ' ILE . 13.0 t30 -71.31 -30.82 66.69 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.659 0.784 . . . . 73.54 111.725 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.433 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 22.8 tp -62.29 -40.07 95.06 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 123.411 0.444 . . . . 74.11 111.086 176.104 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.401 HD13 ' HE1' ' A' ' 57' ' ' TYR . 66.1 mt -70.91 -32.47 69.41 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.336 -0.847 . . . . 73.31 111.065 177.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.0 t -70.62 -26.22 63.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.514 0.726 . . . . 75.51 112.435 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 10' ' ' ASN . 97.1 mt -61.77 -48.47 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 122.864 0.466 . . . . 54.25 111.319 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -98.0 -76.18 0.53 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.627 -0.261 . . . . 55.33 110.803 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.705 ' HA ' HD21 ' A' ' 23' ' ' LEU . 15.8 t-20 53.65 81.13 0.1 Allowed 'General case' 0 N--CA 1.474 0.739 0 O-C-N 124.925 1.391 . . . . 74.12 111.7 -177.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -102.57 -95.2 0.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.713 -0.395 . . . . 71.53 111.316 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.535 ' H ' ' HA3' ' A' ' 22' ' ' GLY . . . -118.59 82.35 0.33 Allowed Glycine 0 CA--C 1.501 -0.806 0 C-N-CA 120.561 -0.828 . . . . 62.13 111.687 -177.288 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.06 43.06 Favored Glycine 0 C--O 1.226 -0.379 0 N-CA-C 111.598 -0.601 . . . . 53.41 111.598 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.408 ' HD3' HG22 ' A' ' 49' ' ' ILE . 2.7 pptp? -89.15 -18.2 27.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.518 0.159 . . . . 73.25 110.939 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 mtt85 -66.39 -51.15 60.0 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 123.424 0.453 . . . . 75.43 110.35 173.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.535 ' HA3' ' H ' ' A' ' 18' ' ' GLY . . . -63.89 -29.16 74.01 Favored Glycine 0 C--N 1.339 0.731 0 O-C-N 123.966 0.791 . . . . 45.44 113.051 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.705 HD21 ' HA ' ' A' ' 16' ' ' ASN . 2.4 mm? -67.9 -51.86 43.04 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-O 118.656 -0.688 . . . . 72.35 111.275 173.133 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.602 ' HG2' HD22 ' A' ' 46' ' ' LEU . 52.8 mtt -63.81 -42.02 97.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.97 0.73 . . . . 63.43 112.97 -175.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -67.78 -38.09 82.93 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.305 0.483 . . . . 74.03 112.305 -177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -79.79 -33.11 40.8 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.277 0.473 . . . . 73.34 112.277 178.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.5 mt -69.22 -47.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 118.908 -0.567 . . . . 53.53 111.374 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.505 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 35.1 m-80 -66.62 -31.13 71.63 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.368 0.507 . . . . 74.22 112.368 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.45 -31.26 60.25 Favored 'General case' 0 N--CA 1.464 0.248 0 O-C-N 123.177 0.298 . . . . 74.21 111.721 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.714 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.57 18.15 22.5 Favored 'General case' 0 C--O 1.223 -0.31 0 N-CA-C 112.689 0.626 . . . . 71.23 112.689 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.505 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 52.5 mt -55.88 -49.31 93.66 Favored Pre-proline 0 CA--C 1.554 1.106 0 N-CA-C 114.121 1.156 . . . . 64.2 114.121 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -79.99 0.14 10.24 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 121.912 1.742 . . . . 62.42 113.409 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.714 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.6 m-85 -97.73 -20.83 17.33 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.197 0.199 . . . . 74.53 111.397 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.3 mtt -75.08 -81.22 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.273 0.358 . . . . 72.45 111.234 -179.144 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.622 ' HB3' ' HB2' ' A' ' 38' ' ' MET . 34.9 t70 -179.08 161.59 1.15 Allowed 'General case' 0 C--N 1.338 0.079 0 N-CA-C 106.812 -1.551 . . . . 64.01 106.812 -170.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.54 -47.04 85.65 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.827 0.451 . . . . 75.04 111.326 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -76.88 -34.31 57.78 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.876 -0.602 . . . . 74.11 110.447 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.622 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 3.6 tpt -72.25 -25.48 61.64 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 123.824 0.703 . . . . 65.25 111.486 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.42 ' HG3' ' HB3' ' A' ' 31' ' ' LEU . 13.0 ttp180 -70.63 -40.55 73.05 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 122.417 0.287 . . . . 74.34 110.727 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.51 -30.12 64.22 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.246 0.546 . . . . 71.21 110.587 178.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.15 -34.96 71.47 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 115.067 -0.969 . . . . 63.43 110.639 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.433 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -65.14 -40.03 93.82 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 116.164 -0.471 . . . . 65.13 111.574 175.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -68.46 -30.06 68.84 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.623 0.577 . . . . 61.0 111.553 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 tpp180 -71.07 -46.97 60.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.09 0.556 . . . . 74.1 111.552 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 49' ' ' ILE . 11.2 m -70.62 -44.04 68.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.112 -0.494 . . . . 73.13 111.302 -176.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.602 HD22 ' HG2' ' A' ' 24' ' ' MET . 52.8 mt -70.48 -27.28 64.09 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.671 0.619 . . . . 73.23 112.671 -177.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.49 -29.15 70.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.754 0.311 . . . . 72.51 111.704 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.477 ' HD2' HD11 ' A' ' 4' ' ' LEU . 14.9 tmtt? -81.53 -33.22 31.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.196 -0.457 . . . . 74.1 110.51 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.52 ' HA ' HD12 ' A' ' 52' ' ' LEU . 11.4 mt -90.8 -11.51 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-O 120.835 0.35 . . . . 70.22 111.458 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.78 -46.34 99.57 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 113.889 1.07 . . . . 74.32 113.889 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -75.66 -6.45 17.62 Favored 'Trans proline' 0 C--N 1.378 2.095 0 CA-C-N 121.76 1.664 . . . . 64.41 113.542 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.52 HD12 ' HA ' ' A' ' 49' ' ' ILE . 65.3 mt -90.11 158.22 17.39 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.603 -0.517 . . . . 61.54 109.603 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 55' ' ' ASN . 8.7 t -112.74 -167.37 1.18 Allowed 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.19 -0.67 . . . . 72.35 109.19 171.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.41 -29.16 69.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.122 0.569 . . . . 74.53 112.129 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.491 ' H ' HG23 ' A' ' 53' ' ' THR . 21.1 t-20 -65.0 -46.23 82.25 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.745 0.653 . . . . 74.13 110.348 177.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 2.4 mp0 -69.2 -28.79 66.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.996 0.739 . . . . 72.02 112.996 -178.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.401 ' HE1' HD13 ' A' ' 12' ' ' LEU . 77.9 t80 -72.45 -37.42 68.54 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 120.842 -0.343 . . . . 73.53 110.27 175.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.27 -14.04 60.48 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.436 0.532 . . . . 72.23 112.436 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 14.0 mm-40 -63.21 -31.55 72.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.084 0.469 . . . . 75.35 110.389 168.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.4 mt -89.59 -61.76 1.62 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.498 -0.774 . . . . 55.42 109.986 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.3 45.73 26.64 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 124.766 1.291 . . . . 53.12 112.495 178.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 40.9 mm 66.72 95.92 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 C-N-CA 124.796 1.238 . . . . 73.0 110.151 -174.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -85.21 -56.91 3.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.773 -1.103 . . . . 55.03 112.09 -171.055 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.492 ' H ' HG21 ' A' ' 9' ' ' THR . . . -114.9 -97.35 0.45 Allowed 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.934 -0.575 . . . . 73.13 111.75 -170.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.407 0 C-N-CA 126.152 1.781 . . . . 53.23 114.848 176.732 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.477 HD22 ' HZ2' ' A' ' 48' ' ' LYS . 96.6 mt . . . . . 0 CA--C 1.509 -0.604 0 CA-C-O 120.652 0.263 . . . . 73.51 110.802 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 153.13 27.16 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.778 -0.647 . . . . 35.25 109.979 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.41 -34.18 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.527 0.331 . . . . 74.32 110.865 176.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.1 -38.56 88.52 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.009 0.524 . . . . 74.41 111.4 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 36.9 mt-10 -70.42 -37.6 74.44 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 117.486 0.13 . . . . 72.44 111.31 178.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.594 ' HA ' HD12 ' A' ' 12' ' ' LEU . 5.9 m -74.81 -29.51 61.11 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 123.485 0.49 . . . . 64.32 111.369 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.465 ' O ' HG13 ' A' ' 14' ' ' ILE . 29.2 t-20 -70.92 -35.88 72.45 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.492 -0.322 . . . . 54.33 110.422 172.237 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.6 tp -65.95 -34.42 78.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.582 0.753 . . . . 42.45 110.882 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.78 ' HA ' HD11 ' A' ' 23' ' ' LEU . 95.6 mt -62.12 -39.99 94.38 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.514 -0.766 . . . . 62.11 110.831 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.3 t -70.41 -31.39 68.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.058 0.543 . . . . 34.41 112.27 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ASN . 77.4 mt -68.77 -45.21 81.37 Favored 'Isoleucine or valine' 0 C--N 1.347 0.463 0 CA-C-O 120.908 0.385 . . . . 75.12 110.731 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -108.33 23.62 14.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.324 0.49 . . . . 75.23 112.324 -172.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 65.9 t30 -82.41 114.36 20.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.888 0.375 . . . . 65.21 110.221 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.32 -76.27 0.6 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.48 -0.782 . . . . 73.5 109.534 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.89 61.66 0.6 Allowed Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.961 -0.856 . . . . 75.43 110.961 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.6 -149.22 21.62 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.33 -0.462 . . . . 71.35 112.348 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.516 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -78.87 -15.26 58.57 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 111.789 0.292 . . . . 74.14 111.789 -176.489 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.4 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -68.25 -46.35 70.73 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 109.153 -0.684 . . . . 61.43 109.153 172.133 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.68 -35.54 91.35 Favored Glycine 0 C--O 1.216 -0.98 0 O-C-N 124.025 0.828 . . . . 72.35 113.217 172.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.78 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.7 mm? -64.05 -46.62 83.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 117.117 0.458 . . . . 72.14 112.097 176.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 48.9 mtt -67.8 -42.43 81.62 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.952 0.352 . . . . 74.42 111.952 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 27.5 mm-40 -70.27 -44.05 69.23 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 112.319 0.488 . . . . 71.21 112.319 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -74.56 -31.3 62.05 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.47 0.544 . . . . 74.25 112.47 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 45.3 mt -72.6 -46.71 53.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 119.16 -0.448 . . . . 65.43 110.911 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -68.15 -25.26 65.18 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.693 0.627 . . . . 72.5 112.693 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.07 -26.39 36.33 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 111.469 0.174 . . . . 63.45 111.469 177.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.3 5.48 39.97 Favored 'General case' 0 C--O 1.209 -1.04 0 N-CA-C 112.689 0.625 . . . . 73.11 112.689 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 64.5 mt -60.6 -33.38 14.41 Favored Pre-proline 0 CA--C 1.56 1.351 0 N-CA-C 114.498 1.296 . . . . 74.14 114.498 176.027 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 31' ' ' LEU . 17.0 Cg_endo -60.46 -22.82 73.13 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.142 1.894 . . . . 75.32 114.283 166.313 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -105.12 -140.15 0.37 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.057 0.943 . . . . 74.54 109.181 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 86.0 mtp 73.31 160.09 0.23 Allowed 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.834 1.654 . . . . 75.24 113.194 172.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.49 148.01 47.21 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.05 -1.093 . . . . 71.25 108.05 168.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -67.23 -28.14 67.81 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 118.661 0.664 . . . . 75.24 112.159 -178.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.35 -46.09 77.97 Favored 'General case' 0 C--O 1.215 -0.757 0 O-C-N 123.481 0.488 . . . . 54.14 110.671 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.6 mmt -75.28 -28.64 59.83 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 123.833 0.708 . . . . 74.3 112.549 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -75.01 -48.96 21.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.632 0.773 . . . . 72.23 111.503 -173.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.91 -28.18 62.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.326 -0.397 . . . . 75.12 111.8 177.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.1 tp -64.97 -38.89 92.46 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.899 -0.591 . . . . 71.1 110.551 171.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.94 -28.42 68.27 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.355 1.062 . . . . 74.43 112.655 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -60.17 -39.54 86.82 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 123.671 0.607 . . . . 63.23 110.735 173.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -79.78 -30.58 40.67 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.063 -0.517 . . . . 71.0 111.336 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG12 ' A' ' 49' ' ' ILE . 73.2 m -70.45 -37.39 74.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.707 0.403 . . . . 53.22 111.189 -177.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.53 -31.9 63.92 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 111.406 0.15 . . . . 72.2 111.406 173.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.75 -31.54 71.53 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.666 0.604 . . . . 72.34 112.123 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.477 ' HZ2' HD22 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -87.31 -22.07 25.35 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.769 0.655 . . . . 61.11 112.769 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 45' ' ' THR . 35.6 pt -95.23 -12.29 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.389 0.541 . . . . 74.23 112.279 178.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.36 -44.13 87.11 Favored Pre-proline 0 CA--C 1.561 1.369 0 N-CA-C 113.828 1.047 . . . . 74.32 113.828 173.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -71.96 -10.97 26.94 Favored 'Trans proline' 0 C--N 1.38 2.207 0 CA-C-N 121.767 1.667 . . . . 54.05 113.868 170.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 86.4 mt -91.57 156.15 17.86 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.99 -0.374 . . . . 74.41 109.99 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p -92.43 -178.24 4.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.045 -0.525 . . . . 72.44 109.903 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -78.27 -25.01 46.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.35 -0.386 . . . . 74.53 111.018 175.861 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.87 -32.89 59.91 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 122.807 0.443 . . . . 75.31 111.799 173.623 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.62 -47.98 79.19 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.115 0.259 . . . . 71.43 110.641 173.031 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.85 -23.87 63.35 Favored 'General case' 0 C--O 1.21 -0.996 0 O-C-N 123.781 0.676 . . . . 64.0 111.931 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.8 -35.97 75.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.884 0.765 . . . . 51.21 111.616 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -82.68 -24.04 33.88 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.088 -0.506 . . . . 63.12 111.903 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.1 mt -101.66 16.01 27.13 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.239 0.615 . . . . 41.02 112.263 -175.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -82.78 97.39 8.57 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.228 -0.442 . . . . 41.2 110.446 -176.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.444 HG23 ' HB3' ' A' ' 65' ' ' ALA . 5.3 mp 58.19 78.81 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 125.157 1.536 . . . . 65.4 110.391 179.176 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -100.05 -23.43 14.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.832 -1.076 . . . . 74.24 111.107 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.59 ' H ' HG21 ' A' ' 9' ' ' THR . . . -148.05 80.86 1.48 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.104 0.478 . . . . 73.34 111.048 -177.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.444 ' HB3' HG23 ' A' ' 62' ' ' ILE . . . . . . . . 0 N--CA 1.465 0.304 0 CA-C-N 116.01 -0.541 . . . . 75.13 111.22 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 66.0 mt . . . . . 0 N--CA 1.451 -0.384 0 N-CA-C 109.159 -0.682 . . . . 73.41 109.159 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 34.0 p -84.73 -177.25 6.54 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.481 0.178 . . . . 71.44 111.481 -178.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.762 HD13 ' HB1' ' A' ' 64' ' ' ALA . 15.7 mm -64.26 -36.42 77.03 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.361 -0.382 . . . . 74.22 110.171 177.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -69.03 -46.35 68.15 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.742 0.417 . . . . 75.51 111.546 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.544 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 43.9 mt-10 -68.35 -43.64 77.02 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.982 0.801 . . . . 71.24 111.399 -175.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 64' ' ' ALA . 9.1 m -74.56 -29.68 61.44 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 122.659 0.384 . . . . 41.02 111.747 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -64.75 -42.56 95.08 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.6 0.36 . . . . 63.01 110.8 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.515 HD21 ' HA ' ' A' ' 42' ' ' ALA . 7.0 tp -61.83 -41.8 98.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.99 0.916 . . . . 64.43 111.606 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.808 HD22 HD21 ' A' ' 23' ' ' LEU . 65.9 mt -68.64 -31.25 70.25 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 116.204 -0.453 . . . . 73.54 111.296 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.6 t -70.53 -24.3 62.79 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.609 0.764 . . . . 72.31 111.751 176.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.0 mt -78.03 -42.4 27.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 122.53 0.332 . . . . 73.32 110.717 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -106.78 11.64 29.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.602 0.593 . . . . 62.13 112.602 -173.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -58.45 103.23 0.14 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.385 1.074 . . . . 73.24 111.761 175.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -101.6 -75.65 0.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.373 -0.83 . . . . 63.11 110.223 177.398 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.92 74.45 0.44 Allowed Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.416 -0.674 . . . . 71.42 111.416 -175.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.79 -136.84 19.12 Favored Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 110.874 -0.89 . . . . 64.35 110.874 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.88 -23.11 18.89 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 120.55 0.214 . . . . 75.03 110.857 173.275 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -74.42 -49.91 20.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.791 -0.641 . . . . 72.4 110.371 -176.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.04 -29.94 75.98 Favored Glycine 0 C--N 1.337 0.585 0 O-C-N 123.457 0.473 . . . . 74.31 112.434 172.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.808 HD21 HD22 ' A' ' 12' ' ' LEU . 63.6 tp -61.68 -43.49 98.76 Favored 'General case' 0 C--O 1.218 -0.596 0 C-N-CA 123.275 0.63 . . . . 72.13 110.949 174.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.425 ' HG2' HD13 ' A' ' 46' ' ' LEU . 55.8 mtt -70.08 -40.21 75.15 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.245 0.341 . . . . 73.41 111.81 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.75 -39.59 93.89 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.374 0.421 . . . . 74.15 111.64 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -72.86 -40.27 65.81 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 115.946 -0.57 . . . . 73.14 110.921 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.422 ' HA ' ' HE1' ' A' ' 34' ' ' MET . 32.6 mt -67.38 -46.33 83.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 119.155 -0.45 . . . . 74.21 112.192 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -67.35 -25.24 65.89 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.098 0.777 . . . . 75.42 113.098 -176.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.89 -35.42 24.13 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.476 0.176 . . . . 70.24 111.476 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.532 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.45 16.07 22.86 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 113.078 0.77 . . . . 73.33 113.078 -172.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.8 mt -53.44 -51.18 78.15 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 114.373 1.249 . . . . 72.05 114.373 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.53 -23.52 57.36 Favored 'Trans proline' 0 C--N 1.38 2.22 0 CA-C-N 121.834 1.691 . . . . 74.13 113.409 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.532 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 15.0 m-85 -92.7 10.84 28.95 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.109 0.563 . . . . 73.52 111.127 -173.54 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 62.8 mtt -99.17 16.29 23.28 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.009 -0.541 . . . . 73.4 111.823 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.29 -77.05 0.06 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.956 1.302 . . . . 72.13 111.976 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.65 -53.91 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.199 0.6 . . . . 50.13 109.728 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -70.48 -36.07 73.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 123.682 0.614 . . . . 71.11 112.049 -172.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 16.2 mmt -74.36 -29.57 61.62 Favored 'General case' 0 C--O 1.213 -0.82 0 O-C-N 123.363 0.415 . . . . 72.43 111.461 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -70.9 -52.5 19.7 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.45 0.3 . . . . 74.42 111.584 -177.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -66.64 -36.21 82.01 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.818 -0.628 . . . . 64.21 111.395 -176.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.456 HD11 ' HG2' ' A' ' 8' ' ' GLU . 27.7 tp -70.57 -34.81 72.62 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.8 -0.636 . . . . 54.25 111.02 177.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.515 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -66.96 -37.78 84.89 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 112.611 0.597 . . . . 61.44 112.611 -177.405 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -73.17 -33.59 65.52 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.004 0.19 . . . . 64.04 111.43 178.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 44' ' ' ARG . 64.3 mtt180 -67.58 -43.11 81.36 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.518 0.511 . . . . 64.45 111.324 174.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 49' ' ' ILE . 21.8 m -76.53 -30.59 57.19 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.173 -0.467 . . . . 53.41 111.274 -177.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.425 HD13 ' HG2' ' A' ' 24' ' ' MET . 12.7 mt -69.98 -30.1 67.36 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 118.724 0.693 . . . . 72.34 112.035 175.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.54 -19.31 60.94 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.362 0.414 . . . . 72.14 111.291 173.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -88.76 -24.31 22.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.009 0.523 . . . . 74.33 111.365 177.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.508 HG23 HD12 ' A' ' 52' ' ' LEU . 15.4 mt -94.09 -8.53 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.322 0.582 . . . . 75.24 109.771 175.191 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.8 -41.48 77.49 Favored Pre-proline 0 CA--C 1.557 1.243 0 CA-C-O 118.026 -0.988 . . . . 71.23 113.509 174.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.47 1.71 8.5 Favored 'Trans proline' 0 C--N 1.381 2.278 0 CA-C-N 121.677 1.635 . . . . 75.23 114.124 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.508 HD12 HG23 ' A' ' 49' ' ' ILE . 54.0 mt -96.73 169.31 9.96 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.976 -0.379 . . . . 75.35 109.976 176.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 16.9 p -105.67 -170.64 1.77 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.013 -0.54 . . . . 72.41 109.798 168.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -23.35 44.74 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.767 -0.457 . . . . 73.4 109.767 171.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -66.23 -46.3 77.68 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.798 0.839 . . . . 61.11 109.52 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 17.6 mm-40 -67.18 -29.54 69.25 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.883 0.74 . . . . 75.51 112.986 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -74.73 -36.7 62.65 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 110.43 -0.211 . . . . 75.5 110.43 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.64 -14.98 60.39 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.156 0.428 . . . . 62.1 112.156 177.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.51 -42.96 82.0 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 122.191 0.196 . . . . 74.41 111.309 172.142 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.532 ' HB2' ' CD1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -86.45 -44.96 11.59 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 120.939 -0.304 . . . . 73.21 111.36 178.111 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.3 34.41 22.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.292 1.437 . . . . 65.1 114.44 166.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.3 mm 67.02 93.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 122.452 1.12 . . . . 73.12 109.904 -173.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.532 ' CD1' ' HB2' ' A' ' 60' ' ' LEU . 21.6 p90 -117.35 -2.58 11.55 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.084 -1.417 . . . . 65.21 111.592 -171.187 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.762 ' HB1' HD13 ' A' ' 6' ' ' ILE . . . -153.82 75.31 1.03 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.09 0.471 . . . . 71.31 111.527 -173.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.397 -0.365 . . . . 64.03 111.068 177.434 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.515 HD12 ' HE1' ' A' ' 63' ' ' PHE . 58.3 mt . . . . . 0 CA--C 1.506 -0.745 0 CA-C-O 120.599 0.238 . . . . 65.43 110.623 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.411 HG22 ' HG3' ' A' ' 8' ' ' GLU . 11.5 t -82.0 166.33 19.91 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.436 -0.802 . . . . 74.44 109.448 -174.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.438 ' HA ' ' O ' ' A' ' 64' ' ' ALA . 21.9 mm -59.7 -33.06 50.85 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 O-C-N 123.663 0.602 . . . . 74.31 110.951 -177.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -70.6 -38.91 74.05 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.416 0.895 . . . . 73.31 113.416 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 48.4 mt-10 -68.17 -41.06 82.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.08 0.467 . . . . 72.51 110.889 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.685 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.7 m -74.61 -29.07 61.17 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.127 -0.942 . . . . 44.22 111.468 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -65.45 -38.81 90.95 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.399 0.68 . . . . 63.14 110.688 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.488 HD21 ' HA ' ' A' ' 42' ' ' ALA . 59.9 tp -65.34 -33.67 76.51 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.897 -0.592 . . . . 63.22 110.939 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 77.9 mt -66.07 -36.84 84.29 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.899 -0.591 . . . . 61.4 110.801 173.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 m -65.07 -23.63 67.22 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.288 0.477 . . . . 43.31 112.288 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.9 mt -85.19 -39.83 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 111.677 0.251 . . . . 54.13 111.677 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -120.24 0.81 10.72 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.804 1.409 . . . . 65.05 114.804 -166.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.484 ' HB2' HD23 ' A' ' 23' ' ' LEU . 4.3 t30 -86.65 121.78 29.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.448 0.567 . . . . 72.12 110.15 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.28 -14.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.843 -0.343 . . . . 71.44 111.873 173.12 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.56 61.9 0.32 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.483 -0.865 . . . . 61.34 113.573 -173.402 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.59 -161.53 51.49 Favored Glycine 0 C--O 1.225 -0.458 0 C-N-CA 121.442 -0.409 . . . . 63.25 113.372 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.926 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 54.5 tttt -75.06 -37.15 61.72 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 123.666 0.274 . . . . 75.41 111.432 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -65.23 -48.65 72.58 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-O 118.976 -0.535 . . . . 73.2 110.964 177.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.37 -35.92 91.72 Favored Glycine 0 C--O 1.222 -0.627 0 O-C-N 123.654 0.596 . . . . 53.33 112.858 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.484 HD23 ' HB2' ' A' ' 16' ' ' ASN . 2.4 tm? -62.02 -50.67 71.11 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.443 0.697 . . . . 65.14 110.591 176.278 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.893 ' HG2' HD22 ' A' ' 46' ' ' LEU . 40.7 mtt -71.66 -40.49 69.63 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 112.615 0.598 . . . . 70.1 112.615 -175.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.97 -35.43 78.36 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.294 0.372 . . . . 61.24 111.255 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -66.6 -48.61 68.97 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 123.358 0.411 . . . . 60.4 109.957 175.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.438 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 11.8 mt -61.88 -43.58 97.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 123.732 0.645 . . . . 64.13 112.255 -179.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -64.67 -36.46 84.34 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.467 0.543 . . . . 75.33 112.467 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.11 -27.47 54.05 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.547 -0.297 . . . . 55.44 111.696 178.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.531 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -102.8 15.02 30.52 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 112.864 0.69 . . . . 74.12 112.864 -175.233 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 79.2 mt -58.05 -47.47 98.81 Favored Pre-proline 0 CA--C 1.556 1.176 0 N-CA-C 113.681 0.993 . . . . 74.4 113.681 178.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -83.19 10.41 3.67 Favored 'Trans proline' 0 C--N 1.378 2.122 0 C-N-CA 121.849 1.699 . . . . 73.52 113.603 173.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.458 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 98.2 m-85 -109.81 -3.62 16.56 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.045 0.538 . . . . 74.42 110.217 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.1 mtt -91.7 174.39 7.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.514 -0.766 . . . . 63.21 110.877 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.66 166.55 23.38 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.99 -0.744 . . . . 71.21 108.99 163.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -73.8 -30.47 62.75 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.787 -0.571 . . . . 74.23 110.919 -178.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -72.26 -33.86 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.212 -0.449 . . . . 71.52 110.718 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.3 ttm -75.0 -27.5 60.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.724 -0.671 . . . . 71.55 110.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -75.7 -43.1 48.9 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.516 0.726 . . . . 62.35 111.923 -177.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -72.13 -29.02 63.65 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.658 -0.246 . . . . 73.14 110.994 174.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.96 -30.98 68.47 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 116.148 -0.478 . . . . 75.13 110.278 174.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.543 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -62.78 -43.32 99.11 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 123.004 0.522 . . . . 75.22 111.75 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -69.41 -33.9 73.67 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.365 0.416 . . . . 73.34 111.578 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -65.3 -42.94 92.54 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.347 -0.842 . . . . 60.32 110.727 176.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.806 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 90.6 m -74.24 -36.32 63.89 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.973 -1.012 . . . . 73.32 111.665 -178.275 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.893 HD22 ' HG2' ' A' ' 24' ' ' MET . 49.4 mt -69.43 -31.1 69.22 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.814 -0.553 . . . . 64.34 112.384 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.64 91.81 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.668 0.618 . . . . 65.43 112.668 -177.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.806 ' HE3' ' HA ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -88.93 -7.71 55.54 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.197 0.814 . . . . 64.14 113.197 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.453 HG22 ' HG3' ' A' ' 20' ' ' LYS . 49.8 mt -97.53 -20.83 5.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.964 0.412 . . . . 63.33 109.901 174.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -50.28 -43.69 79.09 Favored Pre-proline 0 CA--C 1.559 1.301 0 N-CA-C 115.64 1.718 . . . . 74.25 115.64 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -80.15 8.64 3.99 Favored 'Trans proline' 0 C--N 1.385 2.458 0 CA-C-N 122.289 1.853 . . . . 74.11 114.474 178.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 40.1 mt -100.48 145.73 27.92 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 110.172 -0.307 . . . . 73.11 110.172 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.5 t -98.15 29.01 3.7 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-O 121.502 0.667 . . . . 73.44 110.852 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.926 ' HG2' ' HB3' ' A' ' 20' ' ' LYS . 47.3 mt-10 83.35 -28.66 0.1 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 126.706 2.002 . . . . 72.35 112.85 172.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -72.4 -33.58 67.27 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.028 0.442 . . . . 74.41 110.931 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -76.97 -29.15 55.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.472 -0.785 . . . . 75.45 110.485 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -71.91 -29.64 64.54 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.402 -0.363 . . . . 65.02 110.848 173.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.47 80.68 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.973 0.416 . . . . 73.31 110.968 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.63 -32.2 65.72 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.921 -1.036 . . . . 54.24 111.117 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.4 mt -86.5 -82.24 0.21 Allowed 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.074 -0.343 . . . . 72.22 110.074 176.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.34 -131.06 2.14 Favored 'General case' 0 C--N 1.35 0.626 0 C-N-CA 125.224 1.41 . . . . 44.43 111.537 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.4 mp -92.66 88.19 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.495 -0.928 . . . . 61.02 108.495 178.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.515 ' HE1' HD12 ' A' ' 4' ' ' LEU . 19.0 p90 -110.04 -32.54 6.98 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.454 -0.794 . . . . 74.14 111.36 -178.321 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.685 ' H ' HG21 ' A' ' 9' ' ' THR . . . -133.81 64.96 1.59 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.63 0.729 . . . . 63.32 111.235 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-O 121.779 0.799 . . . . 73.41 110.259 176.778 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.9 mt . . . . . 0 CA--C 1.509 -0.613 0 N-CA-C 109.508 -0.553 . . . . 65.21 109.508 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.1 p -81.47 163.63 22.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.347 -0.541 . . . . 71.23 109.775 173.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.517 HG23 ' HB1' ' A' ' 64' ' ' ALA . 31.0 mm -67.62 -29.17 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 116.006 -0.543 . . . . 70.23 111.135 -174.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -70.86 -37.43 73.1 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.966 -0.561 . . . . 73.45 110.974 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.4 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 50.0 mt-10 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.604 0.594 . . . . 71.15 112.604 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.743 ' HB ' ' HB3' ' A' ' 64' ' ' ALA . 3.4 m -74.88 -29.32 60.97 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.738 0.304 . . . . 74.34 110.647 178.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.446 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.5 t-20 -67.61 -38.89 84.61 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.096 -0.335 . . . . 74.55 110.096 171.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.754 HD21 ' HA ' ' A' ' 42' ' ' ALA . 19.1 tp -60.71 -38.54 85.41 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.984 0.913 . . . . 72.2 111.64 175.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 89.5 mt -66.77 -32.72 74.19 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.836 -0.62 . . . . 44.5 111.423 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 t -72.0 -29.04 63.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.243 0.617 . . . . 64.25 112.081 177.422 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.69 HD12 ' HA ' ' A' ' 11' ' ' LEU . 71.8 mt -66.44 -42.69 90.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.119 0.568 . . . . 75.4 110.051 178.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.422 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . 75.9 m-85 -111.03 35.28 3.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.809 -0.632 . . . . 74.53 110.91 -175.317 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -83.31 103.7 12.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.482 0.658 . . . . 64.01 111.815 -172.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -142.3 122.2 13.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.793 -1.094 . . . . 64.44 110.122 171.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.04 -96.65 2.0 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.66 -0.7 . . . . 73.23 111.762 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.25 -131.28 1.2 Allowed Glycine 0 C--O 1.216 -0.973 0 N-CA-C 110.667 -0.973 . . . . 55.01 110.667 178.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -64.46 -46.18 84.19 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.63 0.772 . . . . 62.03 111.034 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -71.03 -47.89 56.09 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 123.372 0.42 . . . . 74.15 111.047 -175.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.65 -29.58 75.45 Favored Glycine 0 C--N 1.336 0.53 0 O-C-N 123.868 0.73 . . . . 64.54 113.531 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -43.83 98.25 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.468 0.307 . . . . 73.52 111.097 171.287 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.839 ' HG2' HD22 ' A' ' 46' ' ' LEU . 49.2 mtt -68.72 -38.63 80.36 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.335 0.397 . . . . 45.24 111.004 177.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.06 -44.99 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.171 0.434 . . . . 73.43 112.171 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.422 ' HB3' ' HB3' ' A' ' 15' ' ' TYR . 0.2 OUTLIER -69.48 -43.47 73.12 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.584 0.553 . . . . 60.12 110.576 -179.648 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.48 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 30.9 mt -63.78 -48.19 87.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 119.12 -0.467 . . . . 71.24 111.972 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.7 -30.47 67.05 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.695 0.628 . . . . 73.21 112.695 -176.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.93 -33.72 66.12 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.033 0.208 . . . . 61.24 111.011 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.582 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -95.84 7.57 45.95 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.792 0.664 . . . . 51.24 112.792 -176.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 49.3 mt -60.93 -44.7 95.59 Favored Pre-proline 0 N--CA 1.481 1.119 0 N-CA-C 113.954 1.094 . . . . 64.33 113.954 178.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -65.35 -19.59 61.7 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.023 1.815 . . . . 72.12 114.312 174.243 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.582 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 20.2 m-85 -96.94 -10.49 26.25 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.713 0.292 . . . . 74.23 110.395 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.3 ttm -86.35 143.23 27.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 72.01 110.718 -171.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.42 145.56 51.29 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.851 0.719 . . . . 53.45 109.413 172.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -60.06 -30.58 69.3 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.887 1.069 . . . . 72.44 113.887 -173.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -70.06 -44.61 68.81 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.02 0.438 . . . . 64.31 110.704 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.1 ttm -74.5 -29.65 61.5 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.133 -0.939 . . . . 72.2 111.292 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.427 ' HG3' HD22 ' A' ' 31' ' ' LEU . 22.4 ttt180 -69.26 -44.89 70.99 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.736 0.814 . . . . 73.45 111.729 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.53 -33.2 70.91 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 116.305 -0.407 . . . . 73.35 111.176 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.2 tp -67.91 -40.09 83.46 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.862 -0.608 . . . . 72.44 110.431 175.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.754 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -60.92 -45.08 96.07 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.91 0.884 . . . . 60.12 113.125 -176.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -66.48 -30.16 70.44 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.469 0.481 . . . . 70.5 112.094 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 -76.6 -33.48 58.43 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 123.128 0.267 . . . . 73.13 111.532 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.3 m -71.37 -31.3 67.15 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.569 0.348 . . . . 61.52 110.505 174.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.839 HD22 ' HG2' ' A' ' 24' ' ' MET . 63.1 mt -68.61 -30.27 68.97 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 122.642 0.377 . . . . 74.44 111.379 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.12 61.35 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 123.21 0.319 . . . . 54.44 111.639 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -84.43 -37.16 21.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.701 0.401 . . . . 62.11 111.8 175.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.78 -9.31 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 112.7 0.63 . . . . 61.12 112.7 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.4 -48.96 96.42 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.911 -1.042 . . . . 65.42 113.54 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.63 -4.81 15.42 Favored 'Trans proline' 0 C--N 1.385 2.468 0 CA-C-N 121.646 1.623 . . . . 73.24 113.977 176.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 43.6 mt -89.26 145.95 25.06 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.654 -0.499 . . . . 73.14 109.654 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.485 HG23 ' H ' ' A' ' 56' ' ' GLU . 11.5 t -83.62 163.24 20.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.741 -0.663 . . . . 72.22 109.805 172.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -61.53 -39.65 91.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.019 0.928 . . . . 73.21 111.477 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.9 -35.49 76.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.834 -0.621 . . . . 74.05 112.323 -176.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.485 ' H ' HG23 ' A' ' 53' ' ' THR . 39.2 tt0 -75.87 -33.54 59.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 123.248 0.342 . . . . 72.43 111.033 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -69.89 -30.64 68.13 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.026 0.204 . . . . 71.41 111.034 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.43 -24.2 63.8 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.044 0.387 . . . . 74.5 112.044 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -76.0 -27.29 57.35 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.251 -0.431 . . . . 55.01 111.294 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.482 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.8 mt -81.53 -55.32 4.75 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.922 -0.581 . . . . 64.45 110.757 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.88 -110.3 0.55 Allowed 'General case' 0 C--N 1.348 0.503 0 O-C-N 125.114 1.509 . . . . 63.43 110.183 -168.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.427 HG23 HG22 ' A' ' 9' ' ' THR . 48.3 mm -121.47 105.43 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.111 -0.7 . . . . 63.41 109.111 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.482 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 2.7 m-85 -97.48 24.16 6.9 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.026 -0.534 . . . . 73.23 111.813 178.331 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.743 ' HB3' ' HB ' ' A' ' 9' ' ' THR . . . -148.96 -149.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.315 -0.402 . . . . 44.22 110.114 -177.523 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.225 0 C-N-CA 125.348 1.459 . . . . 55.24 112.435 178.704 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.493 HD22 ' HG2' ' A' ' 8' ' ' GLU . 76.6 mt . . . . . 0 C--O 1.238 0.464 0 N-CA-C 108.395 -0.965 . . . . 73.24 108.395 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 15.3 t -98.67 173.52 6.86 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 109.244 -0.65 . . . . 65.4 109.244 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.464 HG23 ' HB1' ' A' ' 64' ' ' ALA . 10.7 mm -60.32 -24.94 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.953 1.301 . . . . 72.24 112.192 -175.348 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.89 -37.79 70.09 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.724 0.809 . . . . 72.22 112.564 -178.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.522 ' HA ' HD11 ' A' ' 41' ' ' LEU . 1.3 mp0 -63.74 -43.96 94.94 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.174 0.512 . . . . 72.25 110.943 178.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.432 ' HA ' ' HG ' ' A' ' 12' ' ' LEU . 6.7 p -74.96 -25.36 58.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.659 -1.155 . . . . 54.14 112.666 178.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.469 ' O ' HG13 ' A' ' 14' ' ' ILE . 65.7 t30 -66.52 -33.51 75.83 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.916 0.486 . . . . 55.51 111.151 174.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.432 ' HA ' HD12 ' A' ' 14' ' ' ILE . 58.7 tp -62.91 -33.96 76.42 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 122.816 0.446 . . . . 71.34 110.891 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.847 HD22 HD21 ' A' ' 23' ' ' LEU . 13.8 mt -71.46 -38.61 71.27 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.517 -0.765 . . . . 64.55 110.433 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.436 ' HB3' HG21 ' A' ' 62' ' ' ILE . 78.6 p -72.04 -22.19 61.42 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.785 0.661 . . . . 73.25 112.785 179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 10' ' ' ASN . 99.3 mt -60.88 -47.42 93.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.78 0.324 . . . . 73.31 110.218 174.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -91.91 -78.09 0.41 Allowed 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.22 -0.445 . . . . 54.32 110.947 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.6 t30 52.96 71.34 0.49 Allowed 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.727 1.267 . . . . 71.34 110.094 -172.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -140.31 123.25 16.53 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.495 -1.229 . . . . 73.22 109.818 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.34 21.24 79.46 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 115.272 0.869 . . . . 75.11 115.272 168.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.71 -140.49 29.17 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 121.294 -0.479 . . . . 53.42 112.595 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.811 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -76.8 -33.68 57.98 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 123.745 0.32 . . . . 64.32 111.307 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.502 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 38.6 mtt180 -65.28 -61.42 2.13 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 119.427 -0.321 . . . . 71.41 110.96 177.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.28 -30.82 78.71 Favored Glycine 0 C--O 1.214 -1.111 0 O-C-N 124.56 1.163 . . . . 40.4 113.924 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.847 HD21 HD22 ' A' ' 12' ' ' LEU . 26.3 tp -65.18 -48.86 71.96 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 117.317 0.558 . . . . 63.13 110.632 177.25 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.0 mtp -69.95 -36.79 75.55 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 123.423 0.452 . . . . 72.14 111.435 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 62.4 mm-40 -68.74 -39.86 80.12 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.269 0.355 . . . . 74.51 111.779 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -69.59 -42.77 74.0 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 119.382 -0.342 . . . . 35.22 111.397 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.421 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 40.3 mt -62.88 -43.73 99.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 O-C-N 123.784 0.677 . . . . 75.24 112.051 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.25 -39.79 95.61 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.06 0.763 . . . . 74.33 113.06 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.71 29.67 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.83 0.678 . . . . 71.52 112.83 -177.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.652 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -114.47 19.39 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.14 0.793 . . . . 63.34 113.14 -171.657 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 39.3 mt -51.0 -52.58 56.81 Favored Pre-proline 0 CA--C 1.552 1.049 0 N-CA-C 114.117 1.154 . . . . 71.34 114.117 174.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.48 -15.1 41.3 Favored 'Trans proline' 0 C--N 1.382 2.327 0 C-N-CA 121.777 1.651 . . . . 72.23 114.101 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.652 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 55.6 m-85 -96.58 -1.27 47.32 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.278 0.231 . . . . 74.2 111.452 -175.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 66.6 mtt -78.19 -77.82 0.15 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.941 0.4 . . . . 63.15 111.548 178.085 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -162.88 -90.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.107 -0.951 . . . . 62.22 109.136 -167.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 176.18 -51.92 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.765 1.226 . . . . 74.24 108.218 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -73.69 -38.08 64.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.248 -0.887 . . . . 63.11 109.366 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.427 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -62.47 -25.69 68.13 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.628 -1.169 . . . . 73.04 113.237 178.096 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -62.56 -52.6 62.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.138 0.575 . . . . 75.04 111.202 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -68.88 -36.19 77.78 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.441 0.696 . . . . 73.22 111.551 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.522 HD11 ' HA ' ' A' ' 8' ' ' GLU . 61.4 tp -59.64 -38.08 80.42 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.581 1.153 . . . . 54.0 111.807 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.29 82.66 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 124.121 0.888 . . . . 70.1 113.273 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -60.34 -40.82 92.04 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.704 0.628 . . . . 64.22 111.856 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 44' ' ' ARG . 48.0 mtm105 -76.2 -35.18 59.19 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.631 0.604 . . . . 75.13 112.631 -178.597 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.439 HG21 HD21 ' A' ' 12' ' ' LEU . 1.7 m -79.11 -38.6 35.78 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.597 0.221 . . . . 74.21 111.597 -176.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -66.6 -31.09 71.57 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.273 0.472 . . . . 72.53 112.273 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.81 -23.71 64.3 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.638 0.586 . . . . 74.33 111.555 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -88.56 -28.3 20.82 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.256 -0.429 . . . . 63.34 112.033 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.432 ' HA ' HD12 ' A' ' 52' ' ' LEU . 35.6 mt -93.01 -21.11 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 110.703 -0.11 . . . . 71.33 110.703 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.43 -47.58 95.75 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 114.687 1.365 . . . . 72.51 114.687 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.16 5.64 6.11 Favored 'Trans proline' 0 C--N 1.383 2.346 0 CA-C-N 121.902 1.715 . . . . 72.32 114.385 176.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 49' ' ' ILE . 96.1 mt -98.75 168.19 10.3 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.502 -0.555 . . . . 74.33 109.502 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.443 ' OG1' ' HG2' ' A' ' 56' ' ' GLU . 63.5 p -102.96 -179.81 4.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.753 -0.462 . . . . 74.41 109.753 173.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.811 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -75.11 -22.71 58.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.858 -0.61 . . . . 63.52 110.721 174.336 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -74.39 -35.77 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.442 -0.799 . . . . 75.15 110.489 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.443 ' HG2' ' OG1' ' A' ' 53' ' ' THR . 21.5 mm-40 -70.9 -39.22 72.88 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.242 -0.436 . . . . 63.13 110.876 176.025 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -70.05 -28.21 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.173 -0.467 . . . . 73.13 111.045 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.19 -28.55 68.19 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 111.836 0.31 . . . . 60.42 111.836 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.43 -30.23 64.42 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.459 0.303 . . . . 63.31 111.792 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.6 mt -79.01 -54.39 6.07 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.749 -0.463 . . . . 75.14 109.749 -178.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 52.21 42.93 31.0 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 125.214 1.571 . . . . 74.14 112.975 174.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.46 HG13 ' HB2' ' A' ' 12' ' ' LEU . 3.2 mp 68.98 112.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.981 0.912 . . . . 64.05 109.368 -168.483 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.68 -31.43 19.74 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.339 -0.846 . . . . 64.13 111.298 -171.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.464 ' HB1' HG23 ' A' ' 6' ' ' ILE . . . -154.42 128.26 8.78 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.024 0.44 . . . . 61.14 111.459 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.844 -0.616 . . . . 73.41 110.231 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.57 HD11 ' HD2' ' A' ' 48' ' ' LYS . 90.4 mt . . . . . 0 N--CA 1.449 -0.504 0 CA-C-O 120.812 0.339 . . . . 62.41 110.935 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.488 HG22 ' HG2' ' A' ' 8' ' ' GLU . 8.2 t -90.27 169.66 10.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 115.475 -0.784 . . . . 61.05 108.889 167.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.1 mm -63.38 -32.02 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.414 0.686 . . . . 74.41 112.203 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -71.52 -24.28 61.93 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.57 0.581 . . . . 64.32 112.57 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.502 ' HB3' HG23 ' A' ' 45' ' ' THR . 32.5 mm-40 -63.82 -52.53 59.75 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.492 0.663 . . . . 74.12 110.307 176.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -26.4 61.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.648 -1.16 . . . . 75.41 112.25 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -66.92 -39.59 87.4 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.733 0.413 . . . . 75.2 111.152 172.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.631 HD21 ' HA ' ' A' ' 42' ' ' ALA . 27.6 tp -69.43 -37.12 77.27 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.296 0.638 . . . . 65.13 111.153 175.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.7 mt -66.11 -32.06 73.3 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.932 -0.576 . . . . 75.33 111.743 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.1 t -65.75 -32.58 74.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.798 0.687 . . . . 64.01 111.292 177.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 62.6 mt -67.08 -36.66 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 123.3 0.64 . . . . 53.24 110.854 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -116.59 28.5 8.52 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 65.32 112.303 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -83.44 95.76 8.35 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.41 -0.359 . . . . 74.3 110.948 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -166.4 136.06 3.17 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.932 -0.576 . . . . 52.53 110.007 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.38 23.68 60.34 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 115.316 0.886 . . . . 53.45 115.316 169.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 -144.5 31.33 Favored Glycine 0 C--O 1.222 -0.631 0 CA-C-N 117.216 0.508 . . . . 63.22 112.331 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -79.25 -36.92 39.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.523 0.329 . . . . 75.45 110.702 176.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -64.8 -47.84 76.61 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.321 -0.399 . . . . 75.31 110.903 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.68 -35.56 90.01 Favored Glycine 0 C--O 1.219 -0.822 0 CA-C-O 119.326 -0.708 . . . . 54.42 112.773 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.91 -47.19 83.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.939 0.495 . . . . 70.2 111.172 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.458 ' HG2' HD22 ' A' ' 46' ' ' LEU . 42.9 mtt -68.98 -35.59 76.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.792 -0.64 . . . . 71.12 112.133 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -72.57 -33.56 66.87 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.01 0.374 . . . . 74.34 112.01 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -71.03 -37.63 72.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.658 0.383 . . . . 71.41 111.383 176.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.29 -41.95 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 116.211 -0.45 . . . . 71.42 111.349 178.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -70.25 -28.97 65.66 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.92 0.711 . . . . 60.44 112.92 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.23 -28.49 62.19 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.597 0.237 . . . . 72.42 111.306 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.569 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.27 17.83 22.38 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.285 -0.416 . . . . 65.14 112.072 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.9 mt -68.33 -40.77 21.69 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-O 117.925 -1.036 . . . . 72.4 112.968 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.13 -3.0 12.46 Favored 'Trans proline' 0 C--N 1.382 2.305 0 CA-C-N 121.778 1.671 . . . . 74.13 113.885 168.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.569 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.0 m-85 -109.29 -164.01 0.91 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.201 0.6 . . . . 71.12 110.021 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.4 mtm 65.9 -169.9 0.2 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 125.035 1.334 . . . . 51.54 111.776 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -76.05 163.29 27.28 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.775 -0.648 . . . . 73.32 109.683 167.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -73.82 -24.73 59.83 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.726 -0.472 . . . . 73.02 109.726 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -66.09 -44.35 84.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.749 -0.659 . . . . 73.51 110.537 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' MET . . . . . 0.47 ' HG3' HD13 ' A' ' 11' ' ' LEU . 3.2 tpt -75.99 -25.81 56.14 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.421 -0.809 . . . . 63.35 111.205 -178.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -70.86 -44.65 65.94 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.501 1.12 . . . . 74.34 111.4 177.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -68.65 -33.38 73.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.13 -0.487 . . . . 74.21 111.566 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -66.21 -37.72 86.26 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.601 -0.727 . . . . 64.24 110.643 175.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.631 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -60.68 -37.66 82.36 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 113.571 0.952 . . . . 52.4 113.571 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -78.71 -27.44 44.94 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.133 0.271 . . . . 63.23 111.662 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -36.09 74.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.586 0.354 . . . . 75.45 111.153 172.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.502 HG23 ' HB3' ' A' ' 8' ' ' GLU . 1.6 m -81.24 -25.19 36.84 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.902 0.382 . . . . 71.21 111.583 178.679 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.458 HD22 ' HG2' ' A' ' 24' ' ' MET . 29.5 mt -66.58 -27.35 67.65 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.982 -0.449 . . . . 73.32 111.608 168.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.75 -18.17 64.17 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.332 0.493 . . . . 75.04 112.332 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.57 ' HD2' HD11 ' A' ' 4' ' ' LEU . 65.3 tttt -70.23 -56.48 6.69 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 110.07 -0.344 . . . . 75.22 110.07 170.388 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.8 mt -85.39 -20.23 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 112.833 0.679 . . . . 73.11 112.833 -163.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.87 95.88 Favored Pre-proline 0 CA--C 1.557 1.228 0 N-CA-C 114.202 1.186 . . . . 72.43 114.202 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.47 -4.28 14.04 Favored 'Trans proline' 0 C--N 1.377 2.075 0 CA-C-N 121.565 1.595 . . . . 64.05 114.161 172.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 48' ' ' LYS . 78.6 mt -85.38 133.57 34.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.433 -0.58 . . . . 74.44 109.433 176.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -89.19 24.43 2.16 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.763 0.653 . . . . 73.32 112.763 -172.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 76.64 -48.55 0.55 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 126.21 1.804 . . . . 64.02 112.732 173.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -64.48 -37.01 86.06 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.69 0.757 . . . . 70.15 109.657 170.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -68.67 -35.03 76.7 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.382 -1.281 . . . . 65.5 111.32 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -72.47 -24.9 61.25 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.919 0.487 . . . . 74.24 111.313 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -22.57 61.73 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.88 0.696 . . . . 63.34 112.88 -177.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.03 -29.48 49.42 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.837 0.351 . . . . 74.34 111.009 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.9 mt -88.89 -66.99 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.656 -0.702 . . . . 74.43 110.829 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 48.68 -105.76 0.16 Allowed 'General case' 0 CA--C 1.536 0.442 0 O-C-N 125.439 1.712 . . . . 72.44 112.304 -174.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 22.1 mm -115.41 104.31 16.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.595 -0.891 . . . . 75.01 108.595 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -110.41 -3.27 16.19 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.026 -0.534 . . . . 74.01 112.033 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -150.08 79.67 1.36 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.213 0.53 . . . . 52.32 111.63 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.238 0.542 . . . . 65.03 110.389 173.526 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.76 0.314 . . . . 64.54 110.288 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.2 pt -86.63 163.49 2.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 CA-C-N 115.99 -0.55 . . . . 74.4 110.524 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -109.33 115.1 29.35 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.322 -0.621 . . . . 73.31 109.322 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.427 ' H ' ' HZ ' ' A' ' 63' ' ' PHE . 98.4 mt -105.99 155.44 19.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.074 -0.967 . . . . 70.44 110.749 176.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.4 p -82.41 175.15 10.46 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.22 -0.445 . . . . 73.15 111.043 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.46 -38.37 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.303 -0.408 . . . . 73.12 110.34 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.72 -44.61 95.78 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 122.903 0.481 . . . . 75.31 110.989 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.439 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 46.3 mt-10 -65.79 -51.49 58.65 Favored 'General case' 0 CA--C 1.526 0.035 0 O-C-N 124.194 0.934 . . . . 71.34 112.413 -176.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.432 HG21 ' H ' ' A' ' 64' ' ' ALA . 3.0 m -74.18 -28.51 61.32 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 123.346 0.404 . . . . 61.04 111.759 -173.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -70.89 -32.92 70.04 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.385 -0.197 . . . . 72.34 111.437 176.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.468 HD12 HD12 ' A' ' 14' ' ' ILE . 54.8 tp -70.89 -35.52 72.36 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.621 0.248 . . . . 73.13 110.859 175.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.831 HD22 HD21 ' A' ' 23' ' ' LEU . 85.4 mt -67.07 -31.81 72.56 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 116.112 -0.495 . . . . 74.23 110.844 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -65.53 -25.3 67.39 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.841 0.857 . . . . 72.13 111.822 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.468 HD12 HD12 ' A' ' 11' ' ' LEU . 68.7 mt -72.54 -31.36 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 C-N-CA 123.213 0.605 . . . . 63.14 111.074 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.407 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . 94.7 m-85 -123.26 8.22 9.12 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 113.441 0.904 . . . . 72.53 113.441 -173.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.28 106.38 1.09 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.335 0.654 . . . . 72.44 112.316 -178.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -166.18 125.2 1.57 Allowed 'General case' 0 C--O 1.222 -0.384 0 O-C-N 124.127 0.892 . . . . 73.32 109.606 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.73 38.02 24.98 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.355 -0.45 . . . . 72.42 113.129 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.33 -147.66 36.25 Favored Glycine 0 C--N 1.334 0.468 0 N-CA-C 111.688 -0.565 . . . . 61.14 111.688 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.475 ' HG3' ' OE2' ' A' ' 54' ' ' GLU . 2.9 pptp? -93.28 -18.76 22.08 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.429 0.157 . . . . 75.33 110.63 177.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.474 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 18.5 mtp85 -65.93 -57.06 8.72 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.032 -0.531 . . . . 74.51 110.802 174.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.6 -29.0 74.17 Favored Glycine 0 C--O 1.209 -1.436 0 O-C-N 124.028 0.83 . . . . 62.13 112.659 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.831 HD21 HD22 ' A' ' 12' ' ' LEU . 26.3 tp -62.38 -44.57 96.14 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.191 0.596 . . . . 53.52 111.47 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.498 ' HG2' HD22 ' A' ' 46' ' ' LEU . 62.9 mtt -69.46 -36.7 76.84 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 122.514 0.326 . . . . 61.44 111.383 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 39.8 mm-40 -73.25 -30.91 63.79 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 123.29 0.369 . . . . 54.24 111.003 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.407 ' HB3' ' HB3' ' A' ' 15' ' ' TYR . 2.0 m-80 -68.62 -47.77 65.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.154 0.582 . . . . 52.05 111.182 174.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.576 HD12 HD21 ' A' ' 46' ' ' LEU . 44.7 mt -66.05 -48.11 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 O-C-N 123.647 0.592 . . . . 71.41 111.319 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.565 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 20.2 m-80 -70.61 -26.17 63.37 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.234 0.827 . . . . 75.43 113.234 -175.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.37 -28.09 41.92 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.688 0.28 . . . . 54.34 111.38 175.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.713 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -105.23 18.22 22.68 Favored 'General case' 0 C--O 1.221 -0.427 0 N-CA-C 112.18 0.437 . . . . 74.34 112.18 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.801 HD22 ' HG3' ' A' ' 39' ' ' ARG . 86.6 mt -60.19 -47.51 96.58 Favored Pre-proline 0 CA--C 1.554 1.119 0 N-CA-C 113.478 0.918 . . . . 63.22 113.478 176.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.07 -14.48 35.15 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.824 1.683 . . . . 62.21 113.747 175.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.713 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 70.3 m-85 -94.98 -8.43 36.94 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.843 0.354 . . . . 73.42 110.421 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.549 ' HE3' HD23 ' A' ' 31' ' ' LEU . 6.5 ttm -93.82 164.05 13.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.863 -0.608 . . . . 75.03 110.333 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.39 153.69 41.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.491 -0.777 . . . . 74.4 109.545 174.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.26 -41.6 97.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.983 0.364 . . . . 74.14 111.983 -179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.71 -34.78 72.3 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.867 0.365 . . . . 61.54 110.596 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.5 mtt -66.02 -36.52 83.49 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 115.65 -0.705 . . . . 73.24 112.328 174.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.801 ' HG3' HD22 ' A' ' 31' ' ' LEU . 48.8 ttp180 -74.49 -39.81 62.23 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.766 0.427 . . . . 72.34 111.661 -177.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -72.36 -29.04 63.42 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.831 0.348 . . . . 73.12 111.425 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.0 tp -72.09 -35.01 69.1 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.176 -0.466 . . . . 72.2 110.527 172.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.74 96.43 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 112.875 0.694 . . . . 62.15 112.875 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -70.18 -26.62 63.98 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.242 0.339 . . . . 73.3 111.849 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 -74.57 -42.37 58.88 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.437 0.295 . . . . 75.33 111.657 175.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.421 HG23 ' HB3' ' A' ' 8' ' ' GLU . 5.2 m -78.79 -33.6 46.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 73.05 112.213 -175.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.576 HD21 HD12 ' A' ' 27' ' ' ILE . 59.4 mt -69.85 -28.06 65.36 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 122.24 -0.288 . . . . 72.04 111.498 176.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.73 -17.62 62.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 122.564 0.346 . . . . 73.11 111.791 174.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -77.86 -32.26 51.9 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 122.471 0.308 . . . . 75.12 110.601 174.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.469 HG23 HD12 ' A' ' 52' ' ' LEU . 1.8 mt -98.94 -7.12 9.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.036 -0.529 . . . . 74.0 110.68 -175.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.29 -46.68 99.77 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-O 118.094 -0.955 . . . . 43.54 113.327 171.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.51 8.0 4.18 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.788 1.674 . . . . 72.41 114.294 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.469 HD12 HG23 ' A' ' 49' ' ' ILE . 78.1 mt -108.72 168.73 9.13 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.752 0.31 . . . . 72.21 110.81 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -110.37 -168.92 1.37 Allowed 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.159 -0.473 . . . . 73.11 110.602 174.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.475 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 2.9 mp0 -68.03 -29.0 67.88 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.927 0.491 . . . . 65.13 110.549 171.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.17 -45.99 71.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.435 0.694 . . . . 63.42 111.125 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -72.29 -33.58 67.52 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.347 0.499 . . . . 75.53 112.347 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.498 ' HD1' HD12 ' A' ' 60' ' ' LEU . 53.3 t80 -75.85 -25.08 55.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.094 0.247 . . . . 74.21 110.941 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.08 60.14 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.362 -0.211 . . . . 70.25 111.561 175.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.77 -32.96 58.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.423 0.289 . . . . 53.32 110.832 172.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.498 HD12 ' HD1' ' A' ' 57' ' ' TYR . 47.3 mt -70.8 -59.83 2.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.188 -0.671 . . . . 61.12 109.188 173.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.58 28.6 12.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.733 1.613 . . . . 73.1 113.832 171.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 33.1 mm 62.04 89.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.493 0 C-N-CA 124.562 1.145 . . . . 70.45 110.77 -171.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.427 ' HZ ' ' H ' ' A' ' 4' ' ' LEU . 24.1 p90 -97.03 -39.35 9.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.713 -1.131 . . . . 72.43 110.532 177.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.432 ' H ' HG21 ' A' ' 9' ' ' THR . . . -105.9 76.44 1.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.255 0.55 . . . . 42.24 112.364 -173.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -151.69 10.62 0.56 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.166 -0.925 . . . . 50.23 110.13 172.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -98.41 -17.91 18.56 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.705 0.764 . . . . 74.21 109.964 -176.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 49.7 mp0 -78.16 -23.28 47.77 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.816 -1.084 . . . . 61.53 111.414 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.5 m -93.03 -0.6 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 112.161 0.43 . . . . 65.15 112.161 -178.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.7 mt -77.38 -23.8 50.68 Favored 'General case' 0 C--O 1.224 -0.273 0 N-CA-C 111.935 0.346 . . . . 63.41 111.935 -176.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -78.26 -7.65 57.44 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.47 0.544 . . . . 70.03 112.47 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -83.31 -33.41 25.93 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.784 0.434 . . . . 72.15 111.678 -174.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -133.6 -46.96 0.81 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 110.293 -0.262 . . . . 65.35 110.293 -177.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 69.52 95.58 0.07 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.285 1.434 . . . . 62.45 111.305 -170.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -82.06 123.55 29.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.799 -1.092 . . . . 63.44 108.055 171.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -68.47 110.13 4.02 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.808 0.693 . . . . 55.21 111.637 -173.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 114.48 -1.236 . . . . 74.0 109.968 -175.776 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.4 ttm . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 109.312 -0.625 . . . . 73.34 109.312 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.3 tt -78.49 142.34 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 115.837 -0.62 . . . . 75.2 111.496 -177.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.43 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 26.8 mmt180 -83.62 98.85 9.83 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.451 -0.795 . . . . 75.03 111.304 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.8 mt -109.27 140.41 42.94 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.131 -0.94 . . . . 62.11 109.513 174.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -82.57 174.63 10.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.379 -0.373 . . . . 73.43 111.093 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.1 mm -62.68 -34.47 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 123.932 0.77 . . . . 73.54 111.181 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -74.18 -33.43 63.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 122.749 0.419 . . . . 65.11 111.884 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 49.6 mt-10 -73.78 -37.99 64.81 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.471 -0.331 . . . . 64.11 111.181 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.7 p -74.29 -27.21 60.63 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.049 -0.523 . . . . 61.34 112.088 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.467 ' O ' HG12 ' A' ' 14' ' ' ILE . 23.9 t-20 -67.77 -37.56 82.25 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.935 0.494 . . . . 74.21 110.914 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.458 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 17.7 tp -63.4 -37.9 89.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.449 0.7 . . . . 65.12 111.228 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 57.4 mt -68.28 -35.99 78.69 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.404 -0.816 . . . . 63.13 110.595 174.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -70.22 -24.22 63.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.975 0.91 . . . . 55.34 112.303 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 10' ' ' ASN . 40.6 mm -61.14 -45.26 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.023 0.529 . . . . 73.35 110.049 175.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -104.64 -76.0 0.61 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.72 -0.673 . . . . 75.53 111.171 -172.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 65.1 t30 53.4 76.16 0.22 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.257 1.423 . . . . 54.24 112.284 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -153.51 128.74 9.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.208 -0.906 . . . . 54.55 110.216 -177.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.92 37.68 92.35 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 124.057 0.848 . . . . 64.33 114.44 172.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.54 -143.94 37.91 Favored Glycine 0 C--N 1.335 0.527 0 N-CA-C 111.947 -0.461 . . . . 73.13 111.947 -176.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.512 ' HB2' HD12 ' A' ' 49' ' ' ILE . 1.2 pptp? -92.77 -14.84 27.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.554 -0.535 . . . . 61.32 109.554 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -67.92 -52.64 33.92 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.051 -0.977 . . . . 65.03 110.081 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.77 -27.92 73.49 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.269 -0.878 . . . . 50.43 112.75 174.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.492 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -60.02 -42.77 95.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.845 0.323 . . . . 63.14 110.937 172.189 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.868 ' HG2' HD22 ' A' ' 46' ' ' LEU . 51.9 mtt -68.92 -37.55 79.0 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.252 0.345 . . . . 64.54 111.711 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -67.05 -39.88 87.01 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.559 0.537 . . . . 74.2 111.742 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -76.33 -32.88 58.94 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 112.306 0.484 . . . . 75.3 112.306 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 31.7 mt -71.36 -44.99 71.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-O 119.271 -0.395 . . . . 73.51 111.29 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.478 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 m-80 -67.65 -33.84 75.75 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.262 0.467 . . . . 75.4 112.262 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.8 -31.64 64.99 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.256 0.348 . . . . 74.22 111.523 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.752 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.35 20.26 19.17 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 112.907 0.706 . . . . 72.12 112.907 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 80.0 mt -55.9 -47.68 98.25 Favored Pre-proline 0 CA--C 1.555 1.139 0 N-CA-C 113.286 0.847 . . . . 71.54 113.286 175.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.55 3.6 7.6 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.164 1.451 . . . . 72.13 114.245 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.752 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.7 m-85 -103.41 -29.6 11.1 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.705 0.288 . . . . 73.03 110.765 -178.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.3 ptp -81.9 170.63 15.41 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.885 -0.783 . . . . 60.11 108.885 169.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.09 155.11 40.26 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.205 0.316 . . . . 64.52 110.451 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -68.03 -32.75 73.34 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 111.99 0.367 . . . . 73.03 111.99 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.79 -36.09 72.87 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.184 0.516 . . . . 65.44 111.091 175.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 6.5 tpt -72.52 -26.96 61.96 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.956 -1.02 . . . . 72.03 110.881 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -73.38 -39.33 65.2 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.237 1.015 . . . . 73.43 111.371 178.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.18 -35.29 79.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.475 -0.33 . . . . 62.31 111.188 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.61 -40.17 76.76 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.646 -0.706 . . . . 65.44 110.82 173.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.571 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -58.86 -45.24 90.58 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 124.078 0.951 . . . . 62.1 113.47 -175.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -67.37 -28.97 68.39 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.569 0.543 . . . . 74.32 111.828 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.476 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 78.5 mtp180 -78.95 -33.77 44.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.355 -0.384 . . . . 70.11 111.544 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.426 ' O ' HG12 ' A' ' 49' ' ' ILE . 17.7 m -73.82 -27.24 61.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 122.781 0.433 . . . . 75.21 110.46 175.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.868 HD22 ' HG2' ' A' ' 24' ' ' MET . 38.8 mt -68.72 -30.81 69.53 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 111.406 0.15 . . . . 75.45 111.406 172.137 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.15 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 120.852 0.358 . . . . 72.43 111.407 173.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 74.3 mmtt -78.33 -48.51 15.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 115.938 -0.573 . . . . 75.31 110.261 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.512 HD12 ' HB2' ' A' ' 20' ' ' LYS . 16.0 pt -81.97 -13.3 12.4 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 N-CA-C 113.21 0.818 . . . . 53.23 113.21 -176.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -43.06 -48.36 14.85 Favored Pre-proline 0 N--CA 1.486 1.36 0 N-CA-C 116.338 1.977 . . . . 71.53 116.338 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -82.59 27.62 0.6 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 CA-C-N 122.301 1.857 . . . . 73.22 115.386 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.9 mt -102.11 143.55 31.8 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.78 0.8 . . . . 74.21 111.887 177.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.615 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 22.7 m -101.62 26.31 7.49 Favored 'General case' 0 CA--C 1.56 1.363 0 CA-C-N 114.023 -1.444 . . . . 70.23 110.854 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 77.86 -51.26 0.51 Allowed 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 125.995 1.718 . . . . 74.01 112.652 173.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -70.11 -31.27 68.75 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.701 0.8 . . . . 53.24 110.986 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.615 ' OE1' ' HB ' ' A' ' 53' ' ' THR . 26.4 mp0 -67.53 -35.52 79.25 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.898 -0.592 . . . . 72.23 111.011 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -75.04 -27.25 59.97 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-N 115.807 -0.633 . . . . 75.4 110.335 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.07 -22.73 60.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 117.877 0.308 . . . . 73.11 111.461 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -79.17 -31.21 43.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.957 0.503 . . . . 73.53 111.634 175.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.7 mt -89.14 -51.66 5.47 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.565 -0.289 . . . . 63.15 110.586 -178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.68 -121.71 1.83 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.226 1.81 . . . . 73.44 111.878 178.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 24.3 mm -95.88 100.48 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.401 -1.333 . . . . 65.22 107.401 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -92.06 -26.32 18.37 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.677 -0.692 . . . . 75.51 112.112 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -139.77 88.07 2.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.536 0.684 . . . . 42.2 111.872 -179.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -122.97 16.93 10.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.51 0.671 . . . . 74.24 110.51 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -85.13 -32.06 22.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.595 -0.729 . . . . 60.12 111.092 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -93.29 1.19 57.1 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.927 0.343 . . . . 73.22 111.927 -177.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.9 m -86.57 -34.5 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 109.86 -0.422 . . . . 75.02 109.86 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.5 mt -92.69 113.63 25.96 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 107.932 -1.136 . . . . 73.43 107.932 174.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 71.64 156.84 0.17 Allowed 'General case' 0 N--CA 1.479 0.978 0 O-C-N 125.694 1.871 . . . . 75.35 109.679 -163.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 44.2 m170 78.12 -46.27 0.44 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 125.334 1.454 . . . . 63.42 113.14 177.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -105.47 -8.97 17.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.476 0.179 . . . . 74.45 110.794 173.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -104.09 96.92 6.98 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 109.671 -0.492 . . . . 73.32 109.671 178.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -160.02 151.55 19.83 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.391 -0.822 . . . . 71.5 109.638 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -90.4 164.51 14.28 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.601 -0.272 . . . . 64.44 110.719 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.351 -0.386 . . . . 75.23 110.25 -177.26 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.555 ' HG3' HD22 ' A' ' 60' ' ' LEU . 13.7 tmm? . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 108.821 -0.807 . . . . 71.14 108.821 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.719 HG22 ' H ' ' A' ' 3' ' ' ARG . 7.4 mt 57.12 -155.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.275 0 O-C-N 124.708 1.255 . . . . 73.31 108.699 -173.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.719 ' H ' HG22 ' A' ' 2' ' ' ILE . 5.3 mpt_? -111.21 31.58 5.97 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 120.806 -1.184 . . . . 75.43 109.642 169.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.448 HD22 HG23 ' A' ' 45' ' ' THR . 74.8 mt -70.02 126.37 29.49 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 114.683 -1.144 . . . . 63.41 110.142 175.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.2 166.97 20.9 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.227 -0.897 . . . . 73.44 109.848 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.482 HG22 HG13 ' A' ' 68' ' ' VAL . 31.5 mm -67.94 -24.13 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.17 0.588 . . . . 65.3 111.982 -174.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.23 -34.42 65.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.862 -0.608 . . . . 62.01 110.676 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 40.6 mt-10 -73.51 -37.14 65.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.454 0.471 . . . . 71.24 111.357 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -73.21 -27.66 61.74 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.496 0.498 . . . . 71.43 111.687 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.445 ' O ' HG12 ' A' ' 14' ' ' ILE . 9.0 t-20 -64.48 -40.07 94.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.003 0.521 . . . . 61.05 111.046 171.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.582 HD21 ' HA ' ' A' ' 42' ' ' ALA . 16.7 tp -60.7 -34.34 74.22 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.067 0.947 . . . . 73.32 111.561 175.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.722 HD22 HD21 ' A' ' 23' ' ' LEU . 40.0 mt -71.07 -35.81 72.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.627 -0.715 . . . . 71.24 110.572 178.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.594 ' HA ' HD12 ' A' ' 62' ' ' ILE . 17.1 t -71.23 -23.75 62.06 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.32 -0.854 . . . . 74.11 112.902 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 10' ' ' ASN . 27.8 mm -61.87 -45.78 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.883 0.473 . . . . 72.42 110.142 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -106.33 -84.16 0.51 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.612 -0.709 . . . . 73.12 111.265 -174.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.473 ' H ' HD13 ' A' ' 23' ' ' LEU . 65.0 t30 46.58 87.02 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.238 1.415 . . . . 74.43 112.894 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -93.17 -83.98 0.3 Allowed 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.027 -0.421 . . . . 73.32 110.575 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -120.13 83.81 0.36 Allowed Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 109.987 -1.245 . . . . 73.43 109.987 177.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.07 -134.94 20.67 Favored Glycine 0 N--CA 1.449 -0.46 0 O-C-N 124.395 0.703 . . . . 44.31 111.422 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 3.0 pptp? -97.91 -22.03 16.56 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 123.8 0.353 . . . . 74.3 111.157 178.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HB2' ' OE1' ' A' ' 54' ' ' GLU . 53.3 ttp180 -70.23 -51.04 33.77 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.568 0.543 . . . . 72.15 110.33 -178.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.33 -29.18 71.95 Favored Glycine 0 C--O 1.223 -0.571 0 O-C-N 124.183 0.927 . . . . 42.32 112.592 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.722 HD21 HD22 ' A' ' 12' ' ' LEU . 26.8 tp -63.14 -41.86 99.38 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.264 0.625 . . . . 71.43 110.97 172.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.779 ' HG2' HD22 ' A' ' 46' ' ' LEU . 58.0 mtt -67.42 -37.91 83.77 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 122.979 0.512 . . . . 64.32 111.64 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 49.0 mm-40 -67.09 -37.8 84.58 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 123.411 0.445 . . . . 74.42 110.978 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -71.27 -33.89 70.19 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 112.388 0.514 . . . . 65.41 112.388 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.9 mt -71.56 -46.56 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 123.183 0.302 . . . . 43.23 111.049 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.409 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 22.2 m-80 -71.95 -31.23 66.11 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.053 0.761 . . . . 65.25 113.053 -176.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.87 -30.37 50.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.541 0.2 . . . . 72.43 111.541 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.753 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.68 18.42 19.35 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.448 0.536 . . . . 35.4 112.448 -178.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 71.9 mt -57.81 -46.34 99.74 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 113.521 0.934 . . . . 63.22 113.521 171.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -67.96 -18.26 46.47 Favored 'Trans proline' 0 C--N 1.383 2.353 0 CA-C-N 121.666 1.631 . . . . 73.4 113.399 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.753 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 90.7 m-85 -90.44 -32.78 16.25 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 122.376 0.27 . . . . 74.21 111.574 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptp -81.6 168.9 17.69 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.608 0.242 . . . . 61.01 110.761 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.55 171.81 14.57 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.961 -0.563 . . . . 64.25 112.029 -177.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -36.85 85.44 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.57 -0.741 . . . . 64.52 112.936 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.22 -35.84 66.37 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.394 0.434 . . . . 73.14 110.753 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 50.6 ttm -73.99 -30.48 62.5 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.45 0.469 . . . . 74.33 111.065 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.4 mtm-85 -68.8 -41.56 78.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.766 0.284 . . . . 74.23 111.766 174.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.09 -47.68 85.2 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 123.838 0.711 . . . . 65.34 111.065 175.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.5 tp -61.49 -41.93 98.02 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 124.568 1.168 . . . . 65.3 111.58 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.582 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -55.73 -43.91 77.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.514 1.134 . . . . 74.41 113.468 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -64.12 -36.16 83.13 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.888 0.742 . . . . 61.42 112.441 -176.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -80.12 -34.86 37.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.406 -0.361 . . . . 64.14 111.964 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.448 HG23 HD22 ' A' ' 4' ' ' LEU . 13.7 m -72.28 -39.93 67.98 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.645 0.378 . . . . 65.43 111.618 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.779 HD22 ' HG2' ' A' ' 24' ' ' MET . 63.9 mt -65.93 -29.0 69.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.194 0.442 . . . . 74.42 112.194 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.13 -23.02 63.92 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 123.508 0.505 . . . . 41.03 112.189 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -87.49 -27.82 22.42 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 122.43 0.292 . . . . 71.23 111.665 -178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.56 HG23 HD12 ' A' ' 52' ' ' LEU . 9.9 mt -98.11 -12.39 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 121.144 0.497 . . . . 73.12 110.691 -176.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.01 99.31 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 114.456 1.28 . . . . 60.51 114.456 173.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.99 -12.56 26.04 Favored 'Trans proline' 0 C--N 1.385 2.486 0 CA-C-N 121.863 1.701 . . . . 74.34 114.414 174.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.601 HD11 HD11 ' A' ' 2' ' ' ILE . 72.6 mt -83.46 139.32 33.01 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.625 -0.509 . . . . 75.11 109.625 -176.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 56' ' ' GLU . 11.4 t -82.8 168.41 17.18 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 120.857 -0.337 . . . . 75.23 110.252 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 4.9 tp10 -64.13 -40.34 95.96 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.931 0.892 . . . . 74.41 111.404 -174.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -74.59 -29.73 61.43 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.862 -0.608 . . . . 70.43 111.597 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 53' ' ' THR . 51.5 tt0 -72.11 -36.25 69.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.224 -0.443 . . . . 72.43 111.324 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -74.33 -23.16 59.01 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.318 -0.401 . . . . 70.31 110.744 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.71 -24.71 67.05 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.964 0.357 . . . . 72.25 111.964 174.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -76.17 -25.86 55.64 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.93 0.492 . . . . 75.32 111.588 175.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.555 HD22 ' HG3' ' A' ' 1' ' ' MET . 29.6 mt -93.29 -53.56 4.05 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.258 -0.428 . . . . 74.43 110.42 -175.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 63.92 -85.03 0.02 OUTLIER 'General case' 0 C--N 1.351 0.645 0 C-N-CA 126.477 1.911 . . . . 70.13 112.603 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.594 HD12 ' HA ' ' A' ' 13' ' ' SER . 49.5 mm -120.12 -44.79 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 108.838 -0.801 . . . . 74.41 108.838 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 72.12 -79.83 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.117 1.767 . . . . 74.51 112.669 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.08 69.22 1.48 Allowed 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 121.202 0.525 . . . . 72.24 112.147 -172.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -119.11 -5.34 10.5 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.304 0.574 . . . . 62.4 111.237 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -84.37 1.14 46.53 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.746 -0.661 . . . . 65.53 111.036 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -88.89 -29.25 19.76 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.114 -0.494 . . . . 72.4 111.846 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 HG22 ' A' ' 6' ' ' ILE . 5.7 m -87.07 -31.68 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-O 119.304 -0.379 . . . . 63.15 111.276 175.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.5 mt 64.71 -83.73 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.045 1.338 . . . . 74.21 112.071 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -109.02 136.46 48.51 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-O 121.109 0.48 . . . . 63.1 110.242 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -134.66 -20.33 1.79 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.363 -0.835 . . . . 71.13 110.829 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -135.4 17.22 3.39 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 120.748 -0.381 . . . . 75.23 111.946 -172.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.7 t60 74.83 -54.5 0.66 Allowed 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 125.698 1.599 . . . . 73.53 113.145 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 22.4 m80 68.13 168.98 0.27 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 125.457 1.503 . . . . 75.43 112.933 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -134.23 99.48 4.41 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.332 -0.988 . . . . 74.14 108.332 175.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 . . . . . 0 N--CA 1.479 1.015 0 O-C-N 124.863 1.352 . . . . 75.24 110.76 -175.571 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 ptm . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.801 0.334 . . . . 73.0 110.679 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.0 tt -89.45 149.45 4.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.898 -0.778 . . . . 63.02 108.898 176.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -100.53 102.14 13.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.68 0.753 . . . . 73.51 109.553 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.3 mt -78.97 149.67 32.21 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 114.3 -1.318 . . . . 75.04 109.22 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 14.8 t -72.82 156.09 39.26 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.905 -0.776 . . . . 70.04 108.905 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.613 HD13 ' HB2' ' A' ' 67' ' ' GLU . 48.0 mt -62.39 -27.26 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 123.853 0.861 . . . . 64.54 111.505 -173.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -73.12 -35.07 66.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.909 0.483 . . . . 63.05 111.877 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -73.18 -35.42 66.39 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.262 0.225 . . . . 34.41 110.977 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.611 HG21 ' H ' ' A' ' 64' ' ' ALA . 5.7 m -73.5 -28.95 62.18 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.852 0.72 . . . . 64.32 110.596 178.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.747 ' HB2' HG21 ' A' ' 68' ' ' VAL . 55.0 t30 -66.15 -39.69 90.0 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.904 -0.589 . . . . 71.41 110.879 170.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.465 HD13 ' HG3' ' A' ' 38' ' ' MET . 62.8 tp -67.05 -34.3 77.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.838 0.455 . . . . 70.24 111.064 177.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.635 HD13 ' HE1' ' A' ' 57' ' ' TYR . 72.4 mt -67.97 -32.86 73.57 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.585 -0.734 . . . . 73.34 111.088 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -72.01 -37.28 69.82 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.485 0.714 . . . . 74.51 112.484 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 90.3 mt -69.07 -45.48 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-O 120.968 0.414 . . . . 63.4 110.808 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -102.02 28.08 6.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.125 -0.489 . . . . 72.44 111.545 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.428 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 12.9 t-20 -73.27 100.3 3.1 Favored 'General case' 0 C--N 1.344 0.339 0 O-C-N 123.606 0.567 . . . . 75.22 110.247 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -113.84 -69.25 0.87 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.344 -0.844 . . . . 71.33 111.479 -174.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -146.56 64.0 0.44 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.893 -0.67 . . . . 34.13 111.869 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.19 -157.41 40.85 Favored Glycine 0 C--O 1.225 -0.42 0 C-N-CA 121.443 -0.408 . . . . 51.32 112.1 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -69.53 -33.9 73.47 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 122.595 0.358 . . . . 72.22 111.495 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.497 ' HA ' ' HD3' ' A' ' 21' ' ' ARG . 12.3 mmt180 -73.45 -43.46 60.25 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-O 118.803 -0.618 . . . . 65.22 112.133 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.82 -27.72 71.58 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 120.982 -0.628 . . . . 54.13 112.905 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.596 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.3 mm? -67.56 -54.49 19.47 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 122.843 0.457 . . . . 72.22 111.27 170.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.765 ' HG2' HD22 ' A' ' 46' ' ' LEU . 30.8 mtt -64.45 -44.46 91.02 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.014 0.746 . . . . 73.31 113.014 -174.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 18.1 mm-40 -68.9 -36.6 78.22 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 122.71 0.404 . . . . 63.32 111.795 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -70.91 -46.28 62.8 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.955 -0.387 . . . . 75.43 109.955 177.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.424 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 34.5 mt -62.29 -41.96 93.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.32 0.648 . . . . 74.55 112.338 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.14 -42.82 95.69 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.308 0.643 . . . . 71.22 112.183 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -27.34 36.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 72.35 112.073 -177.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.751 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -97.48 11.39 36.95 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 113.173 0.805 . . . . 74.31 113.173 -174.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 55.4 mt -57.9 -45.88 99.76 Favored Pre-proline 0 CA--C 1.557 1.215 0 N-CA-C 114.458 1.281 . . . . 73.0 114.458 177.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.3 -12.21 31.47 Favored 'Trans proline' 0 C--N 1.384 2.401 0 C-N-CA 121.815 1.677 . . . . 75.31 113.999 173.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.751 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 74.3 m-85 -96.77 -7.84 32.75 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.36 0.264 . . . . 75.51 111.24 -178.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.3 mtt -83.05 154.91 24.18 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.317 0.58 . . . . 73.35 111.846 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.74 158.93 35.23 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 114.386 -1.279 . . . . 43.45 109.048 171.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -47.69 -38.94 16.16 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.753 1.221 . . . . 74.32 113.819 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.18 -51.69 42.87 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 123.352 0.407 . . . . 64.24 111.697 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.465 ' HG3' HD13 ' A' ' 11' ' ' LEU . 0.5 OUTLIER -73.74 -28.23 61.58 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.867 0.691 . . . . 74.0 112.867 -173.672 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -68.03 -55.72 11.55 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 123.686 0.794 . . . . 75.3 111.566 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -70.73 -29.23 65.44 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.855 0.687 . . . . 71.32 112.855 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.2 tp -63.8 -38.91 92.86 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 123.734 0.646 . . . . 75.42 110.7 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.473 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -60.86 -37.05 80.76 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 113.711 1.004 . . . . 75.21 113.711 -175.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.62 -37.12 86.47 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.39 0.431 . . . . 51.11 110.743 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -80.07 -31.75 39.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.666 -0.697 . . . . 75.25 111.327 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.1 m -69.66 -43.11 73.24 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 122.856 0.463 . . . . 53.21 110.355 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.765 HD22 ' HG2' ' A' ' 24' ' ' MET . 85.9 mt -68.75 -29.39 67.78 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.654 -0.703 . . . . 72.31 111.731 178.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.79 -24.15 61.69 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 123.438 0.461 . . . . 73.41 111.474 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -87.52 -33.03 19.1 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.347 0.499 . . . . 72.41 112.347 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 34.8 pt -90.92 -13.93 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 112.894 0.702 . . . . 52.31 112.894 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -49.78 91.9 Favored Pre-proline 0 N--CA 1.48 1.067 0 CA-C-O 117.797 -1.097 . . . . 64.55 113.619 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -73.87 -10.73 23.37 Favored 'Trans proline' 0 C--N 1.384 2.435 0 C-N-CA 121.708 1.605 . . . . 75.44 113.213 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 ' HG2' ' A' ' 56' ' ' GLU . 78.0 mt -81.55 148.5 29.11 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.667 -0.494 . . . . 73.2 109.667 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.526 HG23 ' H ' ' A' ' 56' ' ' GLU . 7.1 t -77.95 167.52 21.35 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.399 -0.593 . . . . 65.2 109.399 170.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -66.79 -31.76 72.6 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.886 0.474 . . . . 74.41 110.415 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -73.31 -29.71 62.88 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.36 -0.837 . . . . 74.13 111.008 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.547 ' HG2' HD22 ' A' ' 52' ' ' LEU . 4.9 tp10 -66.73 -46.42 75.53 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.861 0.464 . . . . 74.21 109.793 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.635 ' HE1' HD13 ' A' ' 12' ' ' LEU . 76.0 t80 -67.36 -29.09 68.54 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 123.774 0.671 . . . . 62.45 111.552 177.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.64 -33.45 72.8 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.422 0.527 . . . . 52.34 112.422 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -80.51 -29.5 37.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.319 -0.4 . . . . 75.42 111.514 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.0 mt -104.01 16.7 25.7 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.705 0.631 . . . . 64.13 112.705 -171.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.75 -69.97 0.1 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 62.3 113.294 -169.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mp -121.68 89.55 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 107.227 -1.398 . . . . 71.4 107.227 169.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -90.02 -64.98 1.06 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.997 -1.456 . . . . 64.05 109.945 -178.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.611 ' H ' HG21 ' A' ' 9' ' ' THR . . . -121.35 96.34 5.05 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.37 -0.377 . . . . 75.32 110.853 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -131.69 6.18 4.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.904 0.383 . . . . 73.0 110.546 175.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.93 -35.77 62.16 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.686 -0.688 . . . . 54.21 111.5 -176.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.613 ' HB2' HD13 ' A' ' 6' ' ' ILE . 40.3 mt-10 -92.42 11.54 25.8 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.248 -0.887 . . . . 54.42 112.356 -170.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.747 HG21 ' HB2' ' A' ' 10' ' ' ASN . 3.3 m -119.24 2.88 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.322 -0.399 . . . . 62.23 110.823 169.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.4 mt -77.79 154.1 32.23 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.539 -0.541 . . . . 74.04 109.539 174.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 71.57 9.74 6.4 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 124.898 1.374 . . . . 62.45 111.401 -174.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -85.83 73.95 10.27 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-O 122.411 1.1 . . . . 70.04 108.951 175.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -146.92 -30.63 0.35 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 113.575 -1.648 . . . . 73.34 107.825 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -75.06 135.16 41.23 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 109.1 -0.704 . . . . 73.31 109.1 175.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 54.97 69.0 0.78 Allowed 'General case' 0 N--CA 1.476 0.843 0 O-C-N 124.681 1.238 . . . . 63.22 112.118 -177.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -87.32 103.87 15.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.415 -0.811 . . . . 74.21 109.594 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.286 -0.87 . . . . 73.41 109.998 -178.706 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.542 ' HG3' HD11 ' A' ' 60' ' ' LEU . 50.0 ttm . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 109.893 -0.41 . . . . 75.35 109.893 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.537 HG23 HD21 ' A' ' 52' ' ' LEU . 19.5 pt -91.88 163.1 2.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.055 0.455 . . . . 72.04 111.687 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.39 115.66 30.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.038 -1.097 . . . . 74.42 108.038 174.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt -110.69 155.72 22.03 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.736 -0.665 . . . . 73.43 110.694 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.1 t -88.56 170.69 10.65 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.014 -0.736 . . . . 70.23 109.014 173.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -66.79 -30.97 51.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.039 0.535 . . . . 72.33 111.185 -172.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.406 ' O ' HD21 ' A' ' 41' ' ' LEU . 1.9 mp0 -62.74 -49.82 73.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.252 0.621 . . . . 65.23 111.708 177.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -66.06 -39.27 89.95 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.429 0.691 . . . . 75.11 111.864 -175.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.401 ' HA ' HD12 ' A' ' 12' ' ' LEU . 3.8 p -74.63 -26.34 59.82 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.855 0.687 . . . . 71.12 112.855 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -67.76 -32.48 73.11 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.052 0.541 . . . . 64.31 110.919 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.477 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 16.6 tp -64.55 -39.58 94.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.409 0.684 . . . . 52.51 111.048 172.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 9' ' ' THR . 55.4 mt -69.53 -32.14 70.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.381 -0.827 . . . . 74.4 111.037 178.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.529 ' HA ' HD12 ' A' ' 62' ' ' ILE . 22.6 t -69.37 -24.85 63.93 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 51.42 111.867 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.8 mt -67.19 -44.27 87.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 122.691 0.396 . . . . 72.15 110.341 174.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.449 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 95.5 m-85 -95.98 -86.84 0.3 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.313 0.486 . . . . 75.3 112.313 -175.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.551 ' HA ' HD21 ' A' ' 23' ' ' LEU . 13.4 t-20 53.87 85.32 0.05 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.905 1.282 . . . . 64.05 112.041 -171.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -88.82 -81.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.182 -0.463 . . . . 74.41 111.104 -177.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -163.52 53.6 0.29 Allowed Glycine 0 CA--C 1.499 -0.937 0 N-CA-C 110.5 -1.04 . . . . 73.1 110.5 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.83 -175.28 16.24 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.729 -0.948 . . . . 65.52 110.729 -175.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.458 ' HD3' HG22 ' A' ' 49' ' ' ILE . 3.0 pptp? -83.92 -18.54 37.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.696 0.248 . . . . 71.13 111.565 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.53 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 22.5 ttm180 -65.25 -52.18 56.09 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 123.824 0.702 . . . . 73.45 109.319 172.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.76 -29.6 75.46 Favored Glycine 0 N--CA 1.449 -0.467 0 O-C-N 124.516 1.135 . . . . 54.54 113.378 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.3 mm? -64.07 -42.31 97.02 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 116.901 0.351 . . . . 53.24 110.925 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.657 ' HG2' HD22 ' A' ' 46' ' ' LEU . 64.0 mtt -69.07 -41.19 77.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.848 0.314 . . . . 74.23 111.848 178.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 7.5 mm-40 -65.01 -36.24 83.76 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.61 0.243 . . . . 74.3 111.48 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.449 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.9 m-80 -78.85 -44.1 23.66 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 112.56 0.578 . . . . 72.35 112.56 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.419 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 52.6 mt -64.55 -51.34 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 119.17 -0.443 . . . . 71.21 111.837 -178.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -62.41 -37.52 86.11 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.145 0.794 . . . . 62.41 113.145 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.69 -30.13 27.02 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.491 0.552 . . . . 72.43 112.491 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.528 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -104.47 19.54 20.12 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.229 0.455 . . . . 71.44 112.229 -175.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 89.5 mt -55.05 -45.36 99.85 Favored Pre-proline 0 CA--C 1.559 1.292 0 N-CA-C 113.629 0.974 . . . . 62.41 113.629 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -67.89 -13.55 38.79 Favored 'Trans proline' 0 C--N 1.394 2.952 0 C-N-CA 122.063 1.842 . . . . 74.23 114.094 174.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.528 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.9 m-85 -92.03 -10.44 39.19 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.517 0.198 . . . . 75.34 111.158 178.049 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.0 mtm -99.95 -177.97 3.71 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.34 0.59 . . . . 71.33 111.902 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.37 159.86 28.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.03 -0.987 . . . . 74.43 110.23 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.57 -36.59 83.02 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.203 0.601 . . . . 52.4 111.596 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.45 -35.93 73.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.078 0.466 . . . . 65.21 110.254 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -25.98 61.33 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.456 -0.793 . . . . 53.32 111.839 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 -68.82 -41.83 78.07 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.117 0.567 . . . . 55.11 110.838 177.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -73.04 -31.74 64.63 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.324 -0.398 . . . . 74.24 111.652 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.406 HD21 ' O ' ' A' ' 7' ' ' GLU . 42.9 tp -68.17 -34.66 76.71 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.046 -0.525 . . . . 74.54 111.062 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.477 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -59.0 -41.37 87.49 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 123.625 0.77 . . . . 61.11 112.566 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -66.47 -35.26 79.83 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 123.828 0.705 . . . . 74.43 111.493 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -69.88 -42.82 72.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.963 -0.562 . . . . 72.32 111.447 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.0 m -72.53 -36.75 68.38 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.684 0.615 . . . . 73.22 111.195 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.657 HD22 ' HG2' ' A' ' 24' ' ' MET . 82.5 mt -67.37 -28.32 67.85 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.196 0.443 . . . . 64.41 112.196 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.9 61.35 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.762 0.315 . . . . 73.03 111.534 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -83.7 -32.91 25.3 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.963 0.505 . . . . 71.22 111.315 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.712 HG23 HD12 ' A' ' 52' ' ' LEU . 7.3 mt -94.54 -10.86 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 121.245 0.545 . . . . 73.14 110.797 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.65 -45.77 99.91 Favored Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 114.509 1.3 . . . . 61.4 114.509 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -77.63 -1.88 12.04 Favored 'Trans proline' 0 C--N 1.388 2.61 0 CA-C-N 121.854 1.698 . . . . 72.13 113.605 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.712 HD12 HG23 ' A' ' 49' ' ' ILE . 57.7 mt -86.56 140.79 29.55 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.061 -0.718 . . . . 61.31 109.061 174.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 t -84.22 170.37 13.81 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 108.521 -0.918 . . . . 65.01 108.521 168.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.464 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 15.0 tp10 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.687 0.795 . . . . 64.13 112.88 -166.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -75.29 -28.2 59.64 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.216 -0.902 . . . . 75.54 112.497 -173.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.65 -52.18 66.63 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.573 0.546 . . . . 71.34 112.273 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -69.12 -24.75 64.15 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.624 0.578 . . . . 71.13 111.841 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.4 -29.45 70.51 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 111.798 0.296 . . . . 71.04 111.798 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -81.99 -15.03 55.1 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.589 0.589 . . . . 74.31 112.589 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.542 HD11 ' HG3' ' A' ' 1' ' ' MET . 4.6 mp -84.35 -52.21 6.37 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.363 -0.21 . . . . 73.42 110.675 175.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 57.66 -101.05 0.12 Allowed 'General case' 0 C--N 1.354 0.796 0 O-C-N 125.168 1.542 . . . . 62.24 111.457 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.529 HD12 ' HA ' ' A' ' 13' ' ' SER . 40.1 mm -113.89 90.94 1.61 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 107.635 -1.246 . . . . 63.13 107.635 169.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -96.28 105.27 17.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.916 -0.772 . . . . 72.25 108.916 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 70.66 -166.13 0.15 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 125.4 1.48 . . . . 72.34 109.995 -166.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.405 ' O ' HG22 ' A' ' 68' ' ' VAL . . . 78.28 -22.45 0.28 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 126.121 1.768 . . . . 55.34 114.866 173.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -74.52 -16.42 60.83 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 117.999 0.363 . . . . 75.42 111.593 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -74.64 -11.7 60.25 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 123.368 0.667 . . . . 74.54 112.155 -176.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 65' ' ' ALA . 14.8 m -78.11 -24.47 13.93 Favored 'Isoleucine or valine' 0 C--N 1.348 0.519 0 CA-C-N 117.989 0.359 . . . . 61.13 110.8 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 44.9 mt -73.87 -19.42 60.72 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.24 0.543 . . . . 72.22 110.523 179.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -94.87 -34.15 12.55 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.348 -0.842 . . . . 75.42 110.003 174.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -71.79 -49.04 42.3 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.073 -0.512 . . . . 74.12 111.903 -172.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -102.52 -23.42 13.9 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 120.664 -0.414 . . . . 53.51 111.697 178.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m80 60.58 -90.8 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.674 1.19 . . . . 73.32 110.844 -170.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -141.68 154.35 45.27 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.333 -1.358 . . . . 71.43 107.333 169.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -87.24 87.78 7.52 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.419 0.628 . . . . 74.31 109.76 174.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 . . . . . 0 C--O 1.234 0.28 0 CA-C-N 114.537 -1.211 . . . . 62.54 108.803 179.123 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.41 ' HG3' HD21 ' A' ' 60' ' ' LEU . 24.3 ttt . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 109.883 -0.414 . . . . 64.4 109.883 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.553 HG21 HD11 ' A' ' 52' ' ' LEU . 18.4 tt -90.66 145.92 6.83 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 CA-C-O 121.149 0.5 . . . . 75.23 109.842 174.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -99.21 105.94 18.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.787 -0.642 . . . . 75.51 110.131 177.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 70.9 mt -108.65 150.59 27.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.53 -0.759 . . . . 63.35 110.256 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.9 t -84.3 170.24 13.87 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.602 -0.518 . . . . 74.33 109.602 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.63 -33.71 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.656 0.782 . . . . 71.41 111.014 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.41 -34.82 65.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.259 0.466 . . . . 73.34 112.259 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 53.8 mt-10 -70.15 -39.59 75.28 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.419 0.155 . . . . 62.31 111.419 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.504 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.5 m -73.91 -28.03 61.33 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 123.562 0.539 . . . . 72.24 110.815 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -65.62 -41.61 92.51 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.949 0.5 . . . . 74.33 110.334 174.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' A' ' 42' ' ' ALA . 51.4 tp -68.15 -34.6 76.64 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.244 -0.889 . . . . 73.55 111.256 177.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 91.5 mt -65.1 -36.02 82.96 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 115.656 -0.702 . . . . 70.11 111.656 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.1 m -65.62 -28.28 69.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 123.811 0.694 . . . . 75.31 112.148 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.411 HD12 ' HA ' ' A' ' 11' ' ' LEU . 55.4 mt -71.39 -37.78 66.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.003 0.521 . . . . 72.41 110.945 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -119.11 27.33 8.91 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.742 0.275 . . . . 72.41 111.742 -174.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.527 ' HA ' HD21 ' A' ' 23' ' ' LEU . 9.7 t30 -76.94 101.21 5.87 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.058 -0.519 . . . . 53.24 111.736 -172.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.458 ' HG3' HD21 ' A' ' 26' ' ' ASN . 26.8 mm-40 -118.66 -117.88 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.488 -0.778 . . . . 75.11 112.249 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -96.64 87.83 0.96 Allowed Glycine 0 C--N 1.341 0.84 0 C-N-CA 121.325 -0.464 . . . . 43.22 112.985 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.28 -150.91 46.16 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 111.645 -0.582 . . . . 51.21 111.645 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.644 ' HG2' ' HB3' ' A' ' 54' ' ' GLU . 4.7 pttp -85.38 -17.39 36.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.751 -0.38 . . . . 72.24 110.431 175.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -67.45 -48.84 66.07 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.894 -0.593 . . . . 71.13 109.942 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.35 -33.08 86.29 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 123.89 0.744 . . . . 72.35 113.342 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.527 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.9 mm? -64.8 -51.78 60.38 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.9 0.35 . . . . 73.51 111.894 176.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.5 mtp -70.77 -34.6 71.98 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.457 0.473 . . . . 74.23 111.648 -173.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -66.45 -43.85 84.42 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 111.974 0.361 . . . . 74.13 111.974 175.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.458 HD21 ' HG3' ' A' ' 17' ' ' GLU . 79.1 m-20 -69.4 -40.87 77.08 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 112.523 0.564 . . . . 74.11 112.523 -178.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.496 ' CG2' ' HB1' ' A' ' 42' ' ' ALA . 63.8 mt -65.89 -44.75 92.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 119.149 -0.453 . . . . 51.31 111.426 -177.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.427 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 49.2 m-80 -70.12 -25.78 63.65 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.562 0.579 . . . . 70.32 112.562 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.86 -27.97 33.23 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 111.655 0.243 . . . . 74.1 111.655 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -98.28 7.65 45.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.934 0.346 . . . . 73.44 111.934 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.427 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 89.2 mt -58.55 -45.38 99.67 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-O 118.3 -0.857 . . . . 71.13 112.955 173.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -64.0 -5.77 9.89 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 122.567 2.178 . . . . 53.42 114.598 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -108.23 -134.56 0.34 Allowed 'General case' 0 C--O 1.242 0.665 0 N-CA-C 108.172 -1.047 . . . . 63.13 108.172 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtt 61.11 -105.44 0.2 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.784 1.234 . . . . 62.44 110.875 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -159.19 -69.08 0.08 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.933 0.893 . . . . 71.41 109.355 172.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 176.01 -40.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.478 1.511 . . . . 71.31 108.507 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.22 -50.39 63.96 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.864 -1.062 . . . . 54.52 110.222 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 42.9 mtp -64.37 -27.9 69.33 Favored 'General case' 0 C--O 1.209 -1.066 0 O-C-N 123.839 0.712 . . . . 73.52 112.212 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -73.73 -49.76 24.04 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.448 0.468 . . . . 73.11 111.705 -176.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -72.47 -32.0 65.88 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.85 0.315 . . . . 73.42 111.85 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.4 tp -69.12 -33.62 73.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.087 -0.506 . . . . 51.12 110.7 174.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.496 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -66.37 -31.67 72.58 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-N 116.006 -0.543 . . . . 63.2 112.084 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -70.38 -31.49 68.75 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.623 0.577 . . . . 75.02 111.381 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 44' ' ' ARG . 43.8 mtt180 -71.05 -38.69 72.53 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.284 0.365 . . . . 75.41 111.55 173.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.487 ' O ' HG13 ' A' ' 49' ' ' ILE . 13.8 m -73.56 -33.92 64.92 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 123.537 0.523 . . . . 70.45 111.227 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 90.1 mt -67.09 -31.92 72.73 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.547 0.339 . . . . 71.32 111.638 174.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.52 -20.34 62.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 123.582 0.551 . . . . 71.35 111.635 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 0.2 OUTLIER -81.22 -40.66 23.48 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.621 -0.263 . . . . 70.42 111.091 176.67 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.493 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.0 mt -89.73 -15.86 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 112.215 0.45 . . . . 71.43 112.215 -172.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -47.51 98.57 Favored Pre-proline 0 CA--C 1.555 1.17 0 N-CA-C 114.13 1.159 . . . . 71.14 114.13 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.21 0.97 9.32 Favored 'Trans proline' 0 C--N 1.378 2.107 0 CA-C-N 121.855 1.698 . . . . 42.5 113.789 174.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.553 HD11 HG21 ' A' ' 2' ' ' ILE . 88.0 mt -87.23 158.08 19.18 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.033 0.444 . . . . 45.4 110.367 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.624 HG23 ' H ' ' A' ' 56' ' ' GLU . 7.5 t -102.02 158.49 16.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.748 -0.834 . . . . 73.01 108.748 169.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.644 ' HB3' ' HG2' ' A' ' 20' ' ' LYS . 4.8 pt-20 -87.2 -4.4 59.1 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.719 0.295 . . . . 74.32 111.064 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.04 -45.44 70.44 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.563 -0.744 . . . . 55.12 109.516 166.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.624 ' H ' HG23 ' A' ' 53' ' ' THR . 29.8 tt0 -76.93 -34.35 57.67 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.889 -0.596 . . . . 74.15 110.854 177.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.417 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 54.9 t80 -67.4 -25.08 65.77 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 123.271 0.357 . . . . 72.33 110.998 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.05 -37.99 81.97 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.094 -0.379 . . . . 64.24 111.246 174.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -79.87 -19.94 47.08 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.386 0.513 . . . . 71.21 112.386 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.41 HD21 ' HG3' ' A' ' 1' ' ' MET . 83.3 mt -84.06 -68.23 0.73 Allowed 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.854 -0.424 . . . . 73.53 109.854 173.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.82 -127.7 2.36 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 125.525 1.53 . . . . 64.23 111.452 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 39.4 mm -99.34 95.34 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 107.974 -1.121 . . . . 63.14 107.974 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -106.34 -7.44 17.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.278 -0.874 . . . . 75.3 111.303 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.504 ' H ' HG21 ' A' ' 9' ' ' THR . . . -137.12 -172.84 3.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.677 -0.861 . . . . 72.45 108.677 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 67.45 18.93 10.09 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.854 1.262 . . . . 51.0 111.802 -175.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -92.14 -14.77 28.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.673 -0.694 . . . . 71.4 110.591 177.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -90.52 -14.63 32.26 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.695 -0.684 . . . . 71.3 111.521 -178.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.6 m -89.49 -5.35 10.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 116.588 -0.278 . . . . 40.1 111.411 -175.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.98 117.02 10.12 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.865 -0.607 . . . . 73.43 110.771 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 75.26 -11.38 1.1 Allowed 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 125.663 1.585 . . . . 75.31 113.765 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -73.55 -36.39 65.64 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.335 0.516 . . . . 74.44 109.906 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -121.51 123.93 43.2 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.722 -0.844 . . . . 54.53 108.722 167.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -95.26 118.24 31.69 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.055 -0.521 . . . . 74.13 110.404 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -138.79 128.44 24.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.851 -0.613 . . . . 65.42 109.583 -178.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -75.12 146.63 41.22 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.912 -0.585 . . . . 55.42 111.323 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.7 m80 . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.398 -0.819 . . . . 74.14 111.159 -176.183 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.3 tpp . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.953 0.406 . . . . 74.15 110.83 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.7 HG12 HD11 ' A' ' 52' ' ' LEU . 18.6 pt -129.42 -178.15 2.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 115.829 -0.623 . . . . 72.44 109.471 173.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -117.22 114.41 23.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.604 0.716 . . . . 74.21 111.574 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 5.1 mp -95.0 152.06 18.64 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.723 -1.214 . . . . 63.41 107.723 167.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.703 HG22 ' HG3' ' A' ' 8' ' ' GLU . 4.2 t -76.14 171.54 14.33 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 109.472 -0.566 . . . . 73.22 109.472 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.853 HG22 HG13 ' A' ' 68' ' ' VAL . 9.1 mm -61.78 -36.67 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.142 0.577 . . . . 74.44 111.859 -170.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.02 -24.9 59.62 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.172 0.805 . . . . 72.42 113.172 176.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.703 ' HG3' HG22 ' A' ' 5' ' ' THR . 46.7 mt-10 -75.42 -38.78 59.62 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 117.762 0.256 . . . . 61.3 111.053 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.12 -28.68 62.4 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.464 0.478 . . . . 74.3 111.871 174.119 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.832 ' HB2' HG11 ' A' ' 68' ' ' VAL . 14.5 t-20 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.472 0.482 . . . . 71.23 110.652 170.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.466 ' HA ' HD12 ' A' ' 14' ' ' ILE . 49.2 tp -64.74 -33.6 76.35 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 124.028 0.83 . . . . 74.4 111.646 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.595 ' HA ' HD11 ' A' ' 23' ' ' LEU . 81.1 mt -59.59 -47.74 84.38 Favored 'General case' 0 C--O 1.214 -0.812 0 O-C-N 124.032 0.833 . . . . 62.34 111.731 175.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 46.2 p -71.55 -23.2 61.72 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.711 0.634 . . . . 71.24 112.711 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.466 HD12 ' HA ' ' A' ' 11' ' ' LEU . 87.9 mt -64.73 -51.52 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 122.766 0.426 . . . . 72.5 111.278 175.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.551 ' HB2' HD13 ' A' ' 23' ' ' LEU . 68.9 m-85 -106.3 29.8 6.51 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.057 0.392 . . . . 73.25 112.057 -174.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 14.7 t-20 -84.09 102.45 12.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.247 -0.433 . . . . 63.54 111.415 -176.102 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -123.22 -26.7 4.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.855 -0.611 . . . . 73.12 111.74 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.12 69.5 0.17 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.698 -0.763 . . . . 64.52 112.055 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.83 -149.28 46.12 Favored Glycine 0 N--CA 1.45 -0.372 0 O-C-N 123.859 0.388 . . . . 52.01 112.439 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.854 ' HE3' ' HA ' ' A' ' 53' ' ' THR . 0.6 OUTLIER -90.4 -11.17 41.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.741 0.305 . . . . 64.22 110.436 178.824 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -65.5 -52.86 49.7 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 123.963 0.905 . . . . 73.12 109.283 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.8 -30.34 74.4 Favored Glycine 0 C--O 1.218 -0.888 0 CA-C-N 114.966 -1.015 . . . . 41.5 112.622 174.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.716 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -62.28 -46.95 86.47 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 117.15 0.475 . . . . 63.11 111.353 175.32 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.614 ' HG2' HD22 ' A' ' 46' ' ' LEU . 46.3 mtt -63.72 -43.77 95.56 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.242 0.617 . . . . 74.34 112.369 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.11 -36.0 64.19 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.584 0.553 . . . . 75.33 112.02 -176.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -74.54 -33.67 62.79 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 119.534 -0.27 . . . . 64.02 111.52 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.488 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 11.9 mt -66.6 -49.73 72.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-O 119.282 -0.39 . . . . 71.04 111.17 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -65.27 -35.59 81.5 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.436 0.532 . . . . 74.44 112.436 -177.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.62 -34.53 58.35 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 111.971 0.359 . . . . 60.12 111.971 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.732 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.11 17.34 21.39 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 112.676 0.621 . . . . 75.01 112.676 -176.155 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 70.3 mt -57.83 -44.44 99.41 Favored Pre-proline 0 CA--C 1.554 1.134 0 N-CA-C 113.673 0.99 . . . . 73.31 113.673 172.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -69.61 -15.97 37.93 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 121.931 1.754 . . . . 55.31 113.787 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.732 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 99.4 m-85 -92.03 -9.95 40.94 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.566 0.346 . . . . 72.22 111.616 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.533 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 65.7 mtt -85.28 162.77 18.98 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.294 0.569 . . . . 65.43 111.309 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.89 149.98 37.67 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 107.064 -1.458 . . . . 74.11 107.064 160.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.63 -25.13 66.07 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.081 0.771 . . . . 75.3 113.081 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -66.46 -48.53 69.63 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.69 0.618 . . . . 75.11 111.095 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 31.8 ttp -77.42 -24.29 50.44 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.501 -0.772 . . . . 75.51 111.155 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.437 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 57.4 ttt180 -63.52 -53.03 58.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.78 1.232 . . . . 75.13 111.878 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.696 0.398 . . . . 71.33 112.059 174.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.4 tp -61.94 -39.0 90.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 122.524 0.33 . . . . 70.03 110.707 172.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.402 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -66.3 -30.18 70.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.187 0.995 . . . . 50.4 112.329 177.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' A' ' 43' ' ' LYS . 14.2 tppt? -65.46 -39.47 92.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.347 -0.842 . . . . 70.1 110.453 175.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.403 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 20.8 mmt180 -71.06 -38.56 72.49 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.654 -0.703 . . . . 50.24 111.85 176.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.47 ' O ' HG13 ' A' ' 49' ' ' ILE . 33.3 m -67.86 -40.4 83.63 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.665 0.603 . . . . 74.2 111.647 -177.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.614 HD22 ' HG2' ' A' ' 24' ' ' MET . 21.4 mt -70.06 -28.76 65.71 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.949 0.351 . . . . 62.03 111.949 178.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.09 -25.57 62.67 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 123.423 0.452 . . . . 72.22 111.427 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 43.5 mmtm -73.72 -49.38 25.89 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 122.433 0.293 . . . . 71.53 111.327 176.363 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.514 HD11 HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -95.42 3.45 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 112.285 0.476 . . . . 75.2 112.285 -169.504 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.415 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . . . -52.64 -48.69 89.68 Favored Pre-proline 0 CA--C 1.556 1.206 0 N-CA-C 114.019 1.118 . . . . 72.55 114.019 171.011 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.415 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 2.8 Cg_exo -80.59 -3.81 12.63 Favored 'Trans proline' 0 C--N 1.379 2.157 0 CA-C-N 121.917 1.72 . . . . 74.54 113.977 173.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.7 HD11 HG12 ' A' ' 2' ' ' ILE . 77.5 mt -104.86 81.72 1.79 Allowed 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.086 0.469 . . . . 64.43 110.195 -177.142 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.854 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 2.7 t -87.13 87.68 7.51 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.165 0.802 . . . . 74.41 113.165 -173.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.436 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 17.0 mm-40 79.72 -66.15 0.17 Allowed 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.976 1.31 . . . . 75.02 113.395 162.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -70.91 -31.19 67.73 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.475 0.71 . . . . 73.42 110.242 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.417 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 1.8 mm-40 -76.52 -28.35 56.33 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.564 -0.744 . . . . 74.54 110.505 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -72.03 -25.54 61.85 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.496 0.718 . . . . 72.15 110.765 174.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.26 -20.69 61.49 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 111.969 0.359 . . . . 74.11 111.969 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.16 -41.61 84.17 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.189 0.519 . . . . 71.23 110.766 168.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.544 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.0 mt -85.93 -61.46 1.75 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.823 -1.08 . . . . 73.43 110.607 -171.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.17 35.34 19.6 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 124.902 1.376 . . . . 73.32 112.772 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp 64.39 104.9 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.948 1.299 . . . . 64.2 110.767 -172.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 13.2 m-85 -93.21 -60.97 1.66 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.729 -0.669 . . . . 71.42 111.675 177.09 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -87.27 80.12 8.33 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.865 0.84 . . . . 72.31 112.122 -171.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -124.09 8.61 8.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.101 -0.954 . . . . 43.41 110.657 177.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -88.69 -33.53 17.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.59 -0.732 . . . . 71.32 110.296 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 71' ' ' HIS . 38.7 mt-10 -89.04 -12.81 40.27 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.54 0.57 . . . . 74.41 112.54 -175.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.853 HG13 HG22 ' A' ' 6' ' ' ILE . 6.2 m -86.28 -1.01 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 113.066 0.765 . . . . 64.01 113.066 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -61.75 -37.12 83.08 Favored 'General case' 0 C--N 1.343 0.318 0 O-C-N 124.036 0.835 . . . . 73.53 111.475 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -129.07 21.04 5.81 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 121.634 0.731 . . . . 54.52 110.809 176.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 2.6 t-80 -91.9 -20.14 21.73 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.378 -0.827 . . . . 75.5 110.194 176.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 -100.28 93.48 5.71 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.94 -0.763 . . . . 73.25 108.94 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -90.83 145.75 24.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.977 -1.011 . . . . 74.03 108.865 -177.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -67.46 132.03 46.84 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.367 0.603 . . . . 73.54 111.886 -174.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -110.34 -11.33 14.54 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.084 -0.71 . . . . 75.14 109.084 170.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 18.6 m80 . . . . . 0 C--O 1.237 0.416 0 CA-C-N 115.842 -0.617 . . . . 64.02 110.113 173.163 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.3 mtt . . . . . 0 N--CA 1.484 1.256 0 CA-C-O 120.652 0.263 . . . . 72.14 110.546 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.543 HG23 ' HG ' ' A' ' 4' ' ' LEU . 12.1 tt -132.54 146.32 33.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 N-CA-C 108.167 -1.049 . . . . 64.02 108.167 168.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -82.3 96.97 8.07 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.752 0.787 . . . . 73.02 110.446 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.543 ' HG ' HG23 ' A' ' 2' ' ' ILE . 77.6 mt -106.82 150.78 26.0 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.63 -1.168 . . . . 63.13 110.039 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.09 161.8 29.65 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.512 -0.551 . . . . 35.14 109.512 168.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.418 ' HA ' ' OG1' ' A' ' 9' ' ' THR . 13.5 mm -80.28 -9.26 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.275 0.56 . . . . 73.51 110.908 -175.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.09 -34.78 73.58 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.905 -0.497 . . . . 71.43 110.58 169.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.2 mm-40 -66.29 -49.14 68.09 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.756 0.66 . . . . 60.43 109.343 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.455 ' HB ' HG23 ' A' ' 62' ' ' ILE . 1.9 p -69.87 -26.89 64.41 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 123.943 0.777 . . . . 60.41 112.884 -177.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.31 -40.4 77.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.511 0.195 . . . . 71.24 111.056 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.1 tp -67.35 -38.94 85.62 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.225 0.61 . . . . 64.14 110.824 174.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 92.1 mt -65.71 -31.81 73.02 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.14 -0.937 . . . . 75.25 112.003 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -69.53 -32.26 70.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.369 0.668 . . . . 71.3 111.762 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 74.9 mt -68.77 -46.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 120.955 0.407 . . . . 73.21 110.283 178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -105.29 26.97 8.73 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.864 0.691 . . . . 74.41 112.864 -173.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.686 ' HA ' HD21 ' A' ' 23' ' ' LEU . 66.2 t30 -71.09 103.92 2.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.323 0.583 . . . . 71.52 111.263 -175.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -90.68 -22.7 21.02 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.646 -1.161 . . . . 74.0 109.892 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.03 -38.23 1.63 Allowed Glycine 0 C--N 1.336 0.555 0 C-N-CA 120.847 -0.692 . . . . 54.24 113.269 177.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.46 ' HA3' ' OE2' ' A' ' 54' ' ' GLU . . . -137.38 179.66 17.86 Favored Glycine 0 CA--C 1.504 -0.621 0 C-N-CA 121.174 -0.536 . . . . 54.24 111.967 -177.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.716 ' HD3' HG22 ' A' ' 49' ' ' ILE . 0.6 OUTLIER -77.59 -29.2 51.9 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 116.9 0.35 . . . . 74.13 110.904 -172.538 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -66.51 -47.84 71.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.835 0.71 . . . . 74.4 110.371 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.51 -32.88 82.97 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.637 -0.711 . . . . 64.35 113.265 176.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.686 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.1 mm? -67.72 -40.65 84.23 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.35 0.5 . . . . 44.41 112.35 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.404 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 96.0 mtp -69.36 -28.91 66.61 Favored 'General case' 0 C--O 1.219 -0.544 0 O-C-N 123.053 0.22 . . . . 73.11 111.582 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -73.43 -43.46 60.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.191 0.196 . . . . 54.14 111.359 173.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.17 -42.53 99.42 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 74.24 111.867 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.745 HG23 ' HB1' ' A' ' 42' ' ' ALA . 83.1 mt -71.82 -42.85 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.053 -0.521 . . . . 75.41 111.518 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 24' ' ' MET . 7.1 t-20 -62.62 -41.6 99.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.184 0.594 . . . . 74.5 111.96 -176.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.98 -34.6 50.83 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.91 -0.586 . . . . 74.21 112.049 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -97.18 18.03 15.88 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 113.242 0.83 . . . . 73.31 113.242 -171.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -54.02 -53.22 60.79 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 113.51 0.93 . . . . 44.21 113.51 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -76.24 -7.83 18.26 Favored 'Trans proline' 0 C--N 1.382 2.329 0 CA-C-N 121.18 1.457 . . . . 73.2 113.954 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.518 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 92.5 m-85 -90.01 -30.91 17.45 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 122.518 0.327 . . . . 72.54 111.769 -175.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.523 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 63.5 mtt -67.53 -75.78 0.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 122.969 0.508 . . . . 65.43 111.817 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.416 ' HB3' ' HB2' ' A' ' 38' ' ' MET . 18.7 t70 179.64 169.74 1.11 Allowed 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 104.96 -2.237 . . . . 44.12 104.96 -172.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.07 -40.04 47.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 119.04 0.836 . . . . 64.14 110.852 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.49 -41.7 72.33 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.225 0.536 . . . . 73.34 111.027 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.416 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 4.2 tpt -69.97 -26.84 64.29 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 114.96 -1.018 . . . . 72.51 111.22 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -69.14 -42.69 75.66 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.477 0.711 . . . . 74.44 111.552 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -65.0 -34.56 78.72 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.562 0.539 . . . . 71.13 111.116 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.6 tp -66.11 -48.99 69.08 Favored 'General case' 0 C--O 1.216 -0.694 0 O-C-N 123.888 0.743 . . . . 71.32 110.444 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.745 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -58.85 -41.01 85.97 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.628 1.171 . . . . 60.22 114.06 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -67.03 -34.89 78.69 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.337 0.398 . . . . 73.31 111.69 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -76.27 -34.23 59.14 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 74.01 111.443 178.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.458 HG22 HD11 ' A' ' 49' ' ' ILE . 7.5 m -65.85 -37.09 85.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.072 0.549 . . . . 61.14 110.741 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.74 -34.05 75.14 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.343 0.868 . . . . 74.01 113.343 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.18 -22.02 62.08 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.903 0.382 . . . . 55.21 111.62 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -88.5 -29.73 19.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.083 -0.508 . . . . 73.41 111.509 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.716 HG22 ' HD3' ' A' ' 20' ' ' LYS . 25.6 mt -91.95 -24.81 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 111.357 0.132 . . . . 65.42 111.357 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.02 -46.49 97.6 Favored Pre-proline 0 CA--C 1.557 1.213 0 N-CA-C 114.699 1.37 . . . . 73.53 114.699 177.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -80.31 3.89 7.28 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 121.64 1.56 . . . . 74.43 114.748 176.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.563 HD22 ' HG2' ' A' ' 56' ' ' GLU . 78.9 mt -88.79 169.14 11.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.444 -0.576 . . . . 74.12 109.444 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.5 p -103.58 174.27 5.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.376 -0.374 . . . . 73.51 110.314 173.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.46 ' OE2' ' HA3' ' A' ' 19' ' ' GLY . 54.4 tp10 -66.1 -36.51 83.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.886 -0.597 . . . . 74.43 110.565 175.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.484 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 52.0 m-80 -74.12 -32.68 63.29 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.828 -0.624 . . . . 65.2 111.859 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.563 ' HG2' HD22 ' A' ' 52' ' ' LEU . 8.0 tp10 -65.75 -37.03 85.25 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.805 0.442 . . . . 75.22 111.769 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.553 ' HB2' ' HB3' ' A' ' 20' ' ' LYS . 45.6 t80 -69.83 -32.95 71.65 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.4 -0.363 . . . . 53.33 110.654 176.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.25 -22.86 57.54 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.123 0.416 . . . . 63.21 112.123 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 13.9 mm-40 -68.0 -39.03 83.31 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.825 -0.435 . . . . 65.34 109.825 171.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.444 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 74.9 mt -71.58 -57.06 4.74 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 115.537 -0.756 . . . . 61.43 110.631 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 59.41 20.46 8.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.238 1.415 . . . . 73.15 112.788 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.455 HG23 ' HB ' ' A' ' 9' ' ' THR . 5.2 mp 56.63 88.37 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 124.767 1.227 . . . . 72.11 110.066 -167.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 55.5 m-85 -68.44 -42.04 79.44 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.44 -0.8 . . . . 73.23 111.344 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.401 ' HB3' HD12 ' A' ' 6' ' ' ILE . . . -122.21 106.8 11.46 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.774 -0.648 . . . . 51.44 111.926 -171.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -143.14 -1.66 1.05 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.679 -0.692 . . . . 63.23 109.946 169.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -100.69 -32.62 10.64 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.747 -0.661 . . . . 62.23 111.792 -169.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -18.23 54.51 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.094 0.405 . . . . 73.43 112.094 -179.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 m -87.06 2.57 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 120.756 0.312 . . . . 75.1 111.804 172.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.94 4.84 52.08 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.221 -0.445 . . . . 75.41 110.677 173.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -70.95 -32.36 69.21 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.338 0.655 . . . . 75.55 109.589 170.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -59.21 123.14 15.69 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 114.932 -1.031 . . . . 75.34 110.353 174.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -75.53 144.83 41.74 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.542 -0.754 . . . . 51.44 110.232 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.1 m80 72.57 115.61 0.05 Allowed 'General case' 0 N--CA 1.487 1.38 0 O-C-N 125.118 1.511 . . . . 75.04 111.118 -174.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -89.75 176.93 6.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.297 -0.865 . . . . 73.53 110.73 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -123.82 46.98 2.12 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.519 -0.764 . . . . 74.11 110.412 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 24.4 t60 . . . . . 0 N--CA 1.484 1.247 0 C-N-CA 124.965 1.306 . . . . 72.34 110.678 -177.387 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.503 ' HG3' HD21 ' A' ' 60' ' ' LEU . 27.1 ttt . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.008 -0.367 . . . . 63.41 110.008 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.9 pt -80.06 134.63 27.1 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 109.463 -0.569 . . . . 63.42 109.463 173.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -97.15 97.47 9.22 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.234 -0.654 . . . . 72.22 109.234 -177.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.548 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 76.1 mt -98.34 161.56 13.63 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.968 -1.015 . . . . 75.45 109.613 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 t -99.31 -174.49 2.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.916 -0.772 . . . . 72.22 108.916 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.512 HG21 ' HB2' ' A' ' 67' ' ' GLU . 4.1 mp -63.85 -30.9 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.645 0.778 . . . . 71.02 112.324 -171.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -65.5 -47.17 76.91 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.642 0.377 . . . . 63.53 111.462 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.565 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 2.2 mp0 -68.38 -37.1 80.08 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.403 0.439 . . . . 65.42 111.542 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.4 m -73.73 -29.5 62.28 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 123.292 0.37 . . . . 55.25 111.478 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -69.55 -35.32 75.33 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.858 0.463 . . . . 70.21 110.461 173.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.501 HD21 ' HA ' ' A' ' 42' ' ' ALA . 14.3 tp -67.23 -40.24 86.34 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.164 -0.471 . . . . 72.02 110.813 174.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.634 ' HA ' HD11 ' A' ' 23' ' ' LEU . 88.5 mt -61.34 -38.95 88.78 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.763 0.665 . . . . 73.15 110.824 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 t -64.21 -34.01 77.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.114 0.966 . . . . 64.45 112.259 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 88.4 mt -74.29 -43.63 49.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 O-C-N 123.299 0.375 . . . . 64.24 111.228 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.492 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 78.9 m-85 -109.61 21.79 16.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.273 0.842 . . . . 75.01 113.273 -167.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.3 t30 -87.1 114.66 23.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.268 0.556 . . . . 74.52 111.361 -177.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.459 ' HB2' ' HA3' ' A' ' 22' ' ' GLY . 28.0 mm-40 -97.82 6.12 48.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.369 -0.832 . . . . 65.03 111.624 176.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.51 51.8 1.18 Allowed Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.914 -0.874 . . . . 61.13 110.914 -175.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.55 167.47 11.72 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.826 -0.509 . . . . 64.2 111.826 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.39 -18.12 57.59 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 111.918 0.34 . . . . 72.23 111.918 -176.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.472 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 48.0 ttm-85 -64.72 -44.1 91.29 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.514 -0.766 . . . . 62.53 109.776 176.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.459 ' HA3' ' HB2' ' A' ' 17' ' ' GLU . . . -61.22 -31.61 77.6 Favored Glycine 0 C--N 1.341 0.838 0 O-C-N 124.014 0.821 . . . . 62.41 113.612 174.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.634 HD11 ' HA ' ' A' ' 12' ' ' LEU . 3.9 mm? -65.81 -43.63 88.09 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 122.548 0.339 . . . . 73.31 111.703 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 54.4 mtt -73.64 -35.4 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.156 0.428 . . . . 75.21 112.156 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 47.1 mm-40 -65.54 -50.35 65.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.647 0.261 . . . . 65.05 111.41 175.105 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.492 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.4 m-80 -69.71 -42.48 73.98 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.167 0.802 . . . . 63.35 113.167 -174.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.544 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 54.9 mt -68.73 -48.53 70.78 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.591 0 CA-C-O 118.84 -0.6 . . . . 74.33 111.763 -178.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -66.63 -30.19 70.41 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.361 0.875 . . . . 72.31 113.361 -175.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.29 -37.86 25.21 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.679 0.251 . . . . 31.14 111.679 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.704 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.43 19.09 15.06 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.579 0.585 . . . . 73.14 112.579 -174.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 51.6 mt -56.32 -51.99 76.61 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-O 118.12 -0.943 . . . . 62.34 112.48 173.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.5 -15.53 45.33 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.025 1.817 . . . . 71.52 114.027 174.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.704 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.7 m-85 -90.88 -5.01 56.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.941 0.496 . . . . 64.14 111.267 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 60.3 mtt -84.2 171.73 12.53 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.019 -0.363 . . . . 64.52 110.019 173.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -77.34 0.14 Allowed 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.384 -0.371 . . . . 70.33 111.216 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -175.94 -47.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.11 0.964 . . . . 60.21 108.779 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.6 -42.41 82.49 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.11 -0.95 . . . . 64.34 109.912 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 2.0 tpt -71.65 -27.04 62.81 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.574 -0.739 . . . . 64.15 111.572 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 39' ' ' ARG . 42.2 ttm180 -74.98 -46.58 34.37 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.022 0.529 . . . . 75.22 111.591 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -62.89 -34.41 77.36 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.069 0.461 . . . . 73.02 111.471 175.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 tp -66.72 -41.63 87.62 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.224 -0.898 . . . . 71.41 110.902 175.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.501 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -63.64 -38.11 89.88 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.456 0.909 . . . . 72.15 113.456 -175.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -64.12 -42.91 96.66 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 123.636 0.585 . . . . 64.31 111.178 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -73.02 -34.6 66.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.709 -0.678 . . . . 74.3 112.334 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.423 ' O ' HG13 ' A' ' 49' ' ' ILE . 35.0 m -71.34 -41.39 69.88 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.599 -0.273 . . . . 73.11 110.971 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.2 mt -65.36 -29.38 70.1 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.656 0.613 . . . . 62.53 112.656 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.08 -19.74 62.43 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.156 0.428 . . . . 51.43 112.156 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -29.21 22.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.316 0.246 . . . . 65.22 111.609 176.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 45' ' ' THR . 4.2 mt -90.17 -14.79 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-O 120.851 0.358 . . . . 65.01 110.683 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -47.02 99.41 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 114.013 1.116 . . . . 72.33 114.013 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -75.58 7.05 3.26 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 121.675 1.583 . . . . 64.24 114.484 172.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.3 mt -106.19 174.26 5.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.886 0.374 . . . . 52.1 110.517 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.6 p -112.01 -168.11 1.27 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.69 -0.856 . . . . 72.51 108.69 167.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.36 -7.8 57.35 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.534 -0.173 . . . . 70.21 110.534 175.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -72.93 -47.73 43.14 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.703 -0.48 . . . . 73.0 109.703 170.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -71.27 -29.43 65.06 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.534 . . . . 64.34 111.701 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -69.42 -36.92 77.16 Favored 'General case' 0 C--O 1.217 -0.629 0 O-C-N 123.278 0.361 . . . . 74.34 110.597 174.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.16 -17.48 60.91 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.031 0.382 . . . . 72.41 112.031 -177.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -66.76 -37.29 84.33 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.117 -0.492 . . . . 74.23 110.826 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.551 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 43.2 mt -83.26 -59.65 2.4 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.72 -0.673 . . . . 71.04 110.799 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.87 -107.22 0.35 Allowed 'General case' 0 C--N 1.344 0.361 0 O-C-N 125.251 1.594 . . . . 44.43 110.67 -171.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 31.2 mm -126.1 98.64 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.674 -0.862 . . . . 73.05 108.674 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.551 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 4.7 m-85 -91.87 -85.94 0.24 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.172 -0.467 . . . . 71.11 111.927 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' ILE . . . -96.5 82.83 3.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.264 0.554 . . . . 75.2 110.99 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -135.44 5.25 3.19 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.577 -0.738 . . . . 65.41 110.124 173.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -96.14 9.75 39.92 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.276 -0.875 . . . . 64.51 110.547 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.512 ' HB2' HG21 ' A' ' 6' ' ' ILE . 7.9 mm-40 -94.87 -3.32 49.0 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.338 -0.846 . . . . 70.41 110.623 178.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -102.47 11.16 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.201 -0.454 . . . . 65.44 111.018 176.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.2 mt -79.89 -23.19 42.03 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.886 0.374 . . . . 74.45 110.434 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.46 -43.06 93.3 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 124.255 1.022 . . . . 65.0 110.582 173.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -85.46 139.38 31.55 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.344 -0.844 . . . . 64.24 109.137 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -76.41 121.09 22.55 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.193 0.521 . . . . 64.3 110.703 -177.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -128.27 109.91 11.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.886 -1.052 . . . . 61.44 110.271 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -80.88 95.53 6.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.923 0.868 . . . . 63.44 109.637 177.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -161.34 -51.23 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 113.933 -1.485 . . . . 74.23 107.58 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 75.2 t60 . . . . . 0 C--O 1.236 0.36 0 CA-C-N 115.023 -0.99 . . . . 65.55 108.522 177.501 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 120.655 0.264 . . . . 71.11 110.614 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.9 tt -92.03 141.82 13.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 108.98 -0.748 . . . . 74.22 108.98 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -94.27 92.54 7.27 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 121.426 0.632 . . . . 71.51 109.316 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.0 mt -105.83 152.36 23.34 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 114.919 -1.037 . . . . 73.33 108.624 171.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -74.01 156.94 37.0 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.584 -0.735 . . . . 73.21 109.519 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.901 HG21 ' HB2' ' A' ' 67' ' ' GLU . 6.1 mm -64.24 -32.85 59.13 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 122.64 0.376 . . . . 72.05 111.142 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -69.7 -34.66 74.21 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.14 -0.482 . . . . 74.11 111.211 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 39.0 mt-10 -69.71 -41.82 74.86 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.584 0.553 . . . . 73.33 111.199 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.5 ' HA ' HD12 ' A' ' 12' ' ' LEU . 2.3 m -75.35 -24.89 57.38 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.482 0.489 . . . . 65.13 111.506 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.46 -36.74 81.75 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.259 -0.276 . . . . 73.02 110.863 169.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.549 HD13 ' HG2' ' A' ' 38' ' ' MET . 46.2 tp -64.66 -36.52 84.53 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.069 0.548 . . . . 64.3 110.074 173.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.776 ' HA ' HD11 ' A' ' 23' ' ' LEU . 81.7 mt -67.11 -39.64 86.71 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.259 -0.882 . . . . 73.42 111.091 173.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.408 ' HA ' HD12 ' A' ' 62' ' ' ILE . 22.8 t -69.41 -26.16 64.49 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.964 0.906 . . . . 75.52 112.919 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 73.8 mt -79.38 -35.23 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 122.277 0.231 . . . . 52.43 110.622 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -114.96 24.64 11.55 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.913 0.709 . . . . 74.23 112.913 -173.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 64.4 t30 -85.26 90.48 7.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.384 0.611 . . . . 54.23 110.112 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -114.67 -25.22 8.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.922 -1.035 . . . . 73.1 111.275 -176.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -169.87 64.86 0.17 Allowed Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.004 -1.093 . . . . 32.2 113.489 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.16 -155.49 47.67 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 111.608 -0.597 . . . . 65.53 111.608 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.494 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 2.6 pptp? -83.51 -11.71 57.12 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.211 0.505 . . . . 75.11 110.324 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 ttp85 -68.35 -53.27 25.21 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.194 -0.669 . . . . 74.31 109.194 170.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.9 -32.93 76.44 Favored Glycine 0 C--N 1.342 0.898 0 O-C-N 124.392 1.058 . . . . 60.13 113.442 173.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.776 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.6 mm? -68.14 -49.71 59.29 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 117.11 0.455 . . . . 61.42 112.196 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.507 ' HG2' HD22 ' A' ' 46' ' ' LEU . 50.7 mtt -66.72 -34.16 77.23 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.518 0.562 . . . . 71.52 112.518 -176.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -70.07 -51.22 33.7 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.33 0.252 . . . . 75.41 111.556 175.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -76.66 -29.25 56.3 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.997 0.74 . . . . 72.41 112.997 -170.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.464 HD11 HD12 ' A' ' 23' ' ' LEU . 60.6 mt -69.04 -50.45 53.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 117.88 0.309 . . . . 75.15 110.447 175.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -67.61 -33.33 74.78 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.113 0.783 . . . . 61.42 113.113 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.99 -33.48 61.86 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.776 0.322 . . . . 73.4 111.637 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.718 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.15 19.52 19.41 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.542 0.571 . . . . 71.41 112.542 -176.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.445 HD23 ' HE3' ' A' ' 34' ' ' MET . 61.1 mt -56.4 -50.12 89.47 Favored Pre-proline 0 CA--C 1.55 0.947 0 CA-C-O 118.266 -0.873 . . . . 74.11 112.502 171.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.99 -23.6 53.87 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 121.656 1.57 . . . . 73.33 113.923 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.718 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.0 m-85 -77.78 -36.46 50.43 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.803 0.441 . . . . 60.5 111.628 -177.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.445 ' HE3' HD23 ' A' ' 31' ' ' LEU . 22.3 ptp -82.21 168.81 17.28 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.714 0.292 . . . . 62.33 110.787 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -72.28 154.27 41.07 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.872 -0.603 . . . . 63.32 109.521 176.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 39' ' ' ARG . 29.1 tt0 -70.44 -20.19 62.92 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.673 0.619 . . . . 61.41 112.673 -175.038 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -65.77 -44.8 84.73 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.006 0.431 . . . . 72.33 110.415 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.549 ' HG2' HD13 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -76.27 -25.16 54.67 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.034 -0.985 . . . . 74.12 111.009 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.439 ' HB3' ' HA ' ' A' ' 36' ' ' GLU . 35.8 ttm180 -71.86 -44.71 63.34 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.3 1.04 . . . . 72.13 111.471 -179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -71.26 -29.95 65.71 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.742 0.417 . . . . 74.1 111.462 174.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -61.57 -34.05 74.92 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.201 -0.909 . . . . 75.35 111.381 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.48 75.89 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.548 0.944 . . . . 62.13 113.548 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.07 -38.8 92.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 73.14 110.434 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 44' ' ' ARG . 39.3 mtt180 -71.32 -53.53 13.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.959 -1.019 . . . . 54.14 112.213 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.8 m -61.41 -44.97 96.21 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.651 0.78 . . . . 70.15 112.733 -172.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.507 HD22 ' HG2' ' A' ' 24' ' ' MET . 96.3 mt -64.94 -27.43 68.84 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.783 0.661 . . . . 65.01 112.783 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.4 64.43 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.857 0.688 . . . . 73.43 112.857 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.32 -27.6 29.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.693 0.224 . . . . 60.13 110.997 177.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.446 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.0 mt -97.17 -12.09 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-O 121.041 0.448 . . . . 73.4 110.904 -173.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.12 97.57 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 114.341 1.237 . . . . 73.13 114.341 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -79.51 11.23 2.75 Favored 'Trans proline' 0 C--N 1.383 2.361 0 CA-C-N 122.152 1.804 . . . . 73.43 114.307 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 49' ' ' ILE . 95.8 mt -108.29 -179.66 3.95 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 122.762 0.425 . . . . 63.35 110.118 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.457 HG23 ' OD1' ' A' ' 55' ' ' ASN . 6.4 t -139.11 -169.95 2.77 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.471 -0.937 . . . . 73.45 108.471 174.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -64.79 -43.39 93.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.53 0.732 . . . . 71.34 112.7 -167.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.457 ' OD1' HG23 ' A' ' 53' ' ' THR . 30.7 p-10 -67.78 -32.45 73.03 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.678 0.612 . . . . 72.43 112.285 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -67.17 -41.64 85.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 123.733 0.646 . . . . 71.33 111.844 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.593 ' HE1' HD13 ' A' ' 12' ' ' LEU . 88.5 t80 -75.29 -38.46 60.36 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.477 0.486 . . . . 75.42 111.467 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.81 -24.04 66.83 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.807 1.04 . . . . 71.45 113.807 -168.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.08 -34.08 43.92 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.584 0.216 . . . . 73.3 111.584 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 mt -75.85 -56.38 4.73 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.238 -0.653 . . . . 73.05 109.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.58 -108.52 0.42 Allowed 'General case' 0 C--N 1.346 0.425 0 O-C-N 125.498 1.749 . . . . 73.21 113.17 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.408 HD12 ' HA ' ' A' ' 13' ' ' SER . 17.1 mm -113.2 88.31 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.072 -1.085 . . . . 55.02 108.072 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -103.64 -10.64 18.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.48 -0.782 . . . . 71.41 112.01 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -146.44 82.04 1.58 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 51.51 111.339 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -133.63 19.48 3.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.552 -0.749 . . . . 64.04 109.192 170.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -78.98 -42.76 25.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.967 -1.015 . . . . 72.32 111.201 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.901 ' HB2' HG21 ' A' ' 6' ' ' ILE . 24.6 mm-40 -80.71 -14.43 58.13 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.894 0.702 . . . . 72.31 112.894 -174.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -91.74 2.76 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 111.918 0.34 . . . . 55.41 111.918 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.2 mt -76.39 145.29 39.49 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.389 -0.369 . . . . 65.22 110.245 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 76.72 -20.66 0.36 Allowed 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 126.194 1.797 . . . . 63.25 111.791 -171.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 44.9 m80 -85.67 73.78 10.37 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.076 0.55 . . . . 70.01 111.129 -178.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 53.66 51.06 15.76 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.283 1.433 . . . . 73.35 112.387 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -79.25 135.66 36.83 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.177 -0.92 . . . . 75.25 109.675 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 -68.68 136.44 52.91 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.581 -0.736 . . . . 73.22 109.899 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -66.22 113.74 4.79 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.61 0.569 . . . . 71.42 109.872 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 16.1 t60 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.712 -0.676 . . . . 73.21 110.386 -174.378 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 109.231 -0.655 . . . . 71.32 109.231 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.6 pt -104.59 154.38 6.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-N 115.892 -0.594 . . . . 75.54 110.501 177.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -93.71 112.09 23.89 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 107.85 -1.167 . . . . 74.43 107.85 178.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.597 HD21 ' HG3' ' A' ' 48' ' ' LYS . 85.7 mt -98.12 159.46 14.92 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.119 -0.946 . . . . 72.3 111.527 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' HG2' ' A' ' 8' ' ' GLU . 14.9 t -90.3 166.78 13.13 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.389 -0.823 . . . . 55.52 109.004 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.3 mm -69.41 -27.35 33.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 116.228 -0.442 . . . . 64.23 110.715 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.54 -45.59 78.9 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.592 0.757 . . . . 71.21 112.378 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.479 ' HG2' HG22 ' A' ' 5' ' ' THR . 43.0 mm-40 -64.29 -43.91 93.27 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.556 0.535 . . . . 65.52 110.362 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.69 ' HA ' HD12 ' A' ' 12' ' ' LEU . 3.1 m -73.46 -26.54 60.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.777 -1.101 . . . . 61.21 111.325 -176.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.437 ' O ' HG13 ' A' ' 14' ' ' ILE . 7.8 t30 -69.44 -36.51 76.71 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.005 0.522 . . . . 73.14 111.45 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.623 HD12 HD12 ' A' ' 14' ' ' ILE . 38.0 tp -74.01 -33.17 63.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.879 0.371 . . . . 72.53 110.538 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.69 HD12 ' HA ' ' A' ' 9' ' ' THR . 69.4 mt -63.53 -35.32 80.07 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-N 115.634 -0.712 . . . . 74.53 110.622 170.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -70.68 -24.55 62.7 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.526 0.73 . . . . 74.23 111.988 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.623 HD12 HD12 ' A' ' 11' ' ' LEU . 96.6 mt -69.93 -34.38 59.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 123.006 0.522 . . . . 43.31 110.266 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -107.39 -84.95 0.52 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.26 -0.4 . . . . 70.53 111.309 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.606 ' HA ' HD21 ' A' ' 23' ' ' LEU . 64.3 t30 57.13 83.83 0.1 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.389 1.476 . . . . 62.0 111.829 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.478 ' H ' HD22 ' A' ' 23' ' ' LEU . 38.5 tt0 -149.53 123.63 9.46 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.763 -1.108 . . . . 72.41 110.03 -177.036 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.17 24.02 74.53 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 115.535 0.974 . . . . 71.42 115.535 167.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.92 -150.19 42.35 Favored Glycine 0 C--O 1.221 -0.695 0 C-N-CA 121.153 -0.546 . . . . 71.1 112.497 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 57' ' ' TYR . 14.2 tmtt? -64.97 -43.35 92.94 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.95 0.5 . . . . 73.13 111.085 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -72.81 -45.4 58.68 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.051 -0.977 . . . . 74.33 111.318 -172.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.38 -30.08 74.89 Favored Glycine 0 CA--C 1.524 0.627 0 O-C-N 123.757 0.661 . . . . 75.02 113.137 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' A' ' 16' ' ' ASN . 0.5 OUTLIER -64.24 -37.89 89.09 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.821 0.31 . . . . 71.42 110.905 173.664 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.654 ' HG2' HD22 ' A' ' 46' ' ' LEU . 37.8 mtt -69.42 -39.41 77.88 Favored 'General case' 0 C--O 1.221 -0.415 0 O-C-N 123.234 0.334 . . . . 74.32 111.505 175.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -63.71 -40.81 97.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.693 0.397 . . . . 61.53 111.723 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -77.98 -42.68 32.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.712 -0.676 . . . . 71.25 111.174 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.0 mt -72.63 -38.48 58.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 119.107 -0.473 . . . . 74.22 111.868 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -63.36 -35.76 81.47 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.254 0.479 . . . . 63.52 111.693 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -19.26 61.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.109 -0.496 . . . . 54.41 112.307 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.651 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -113.79 17.29 18.17 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.415 0.524 . . . . 52.14 112.415 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.51 -44.65 56.55 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 113.441 0.904 . . . . 75.22 113.441 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.26 7.95 2.74 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 121.709 1.606 . . . . 55.14 114.122 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.651 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 95.9 m-85 -114.29 -168.8 1.41 Allowed 'General case' 0 C--O 1.242 0.681 0 C-N-CA 123.12 0.568 . . . . 65.45 109.618 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 68.0 mtm 68.16 -88.81 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.309 1.444 . . . . 75.14 111.454 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -167.85 164.1 14.05 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 106.832 -1.544 . . . . 75.02 106.832 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.64 -31.71 71.91 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.043 0.383 . . . . 61.45 111.734 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.34 -39.01 55.06 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.0 0.52 . . . . 64.02 110.508 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 5.7 mtt -68.03 -28.51 67.46 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 115.914 -0.585 . . . . 54.25 111.882 174.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -71.04 -43.02 68.72 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 123.311 0.645 . . . . 62.21 111.156 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -67.98 -32.17 72.38 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 111.562 0.208 . . . . 73.23 111.562 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.72 -48.07 78.56 Favored 'General case' 0 C--O 1.213 -0.846 0 O-C-N 123.644 0.59 . . . . 72.44 109.653 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.63 -34.76 76.24 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.348 1.059 . . . . 53.13 113.537 -177.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -66.27 -35.97 81.79 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 123.688 0.617 . . . . 75.42 111.813 177.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -79.75 -28.98 40.38 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.468 0.48 . . . . 74.03 111.515 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 m -75.35 -30.66 60.31 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.945 0.402 . . . . 75.43 110.39 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.654 HD22 ' HG2' ' A' ' 24' ' ' MET . 67.6 mt -76.71 -31.16 57.02 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.182 0.438 . . . . 70.25 112.182 169.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.42 -33.12 73.65 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.743 0.645 . . . . 74.45 112.743 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.597 ' HG3' HD21 ' A' ' 4' ' ' LEU . 0.1 OUTLIER -86.4 -17.21 34.95 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.914 0.339 . . . . 71.31 111.914 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.53 HG22 HD12 ' A' ' 52' ' ' LEU . 31.7 pt -97.82 -8.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 120.415 -0.514 . . . . 64.4 112.005 174.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.66 -46.32 99.59 Favored Pre-proline 0 CA--C 1.557 1.216 0 CA-C-O 118.261 -0.876 . . . . 61.34 113.208 171.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.45 -5.91 15.92 Favored 'Trans proline' 0 C--N 1.381 2.266 0 CA-C-N 121.62 1.614 . . . . 65.12 114.139 171.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.53 HD12 HG22 ' A' ' 49' ' ' ILE . 76.7 mt -92.17 153.07 19.55 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.886 0.374 . . . . 61.42 110.115 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 p -95.01 -176.89 3.97 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.982 175.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.56 -30.28 69.87 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.902 -0.59 . . . . 75.55 111.362 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -71.72 -39.4 70.16 Favored 'General case' 0 C--O 1.226 -0.183 0 O-C-N 123.724 0.64 . . . . 72.04 110.527 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.3 -42.04 93.48 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 123.716 0.635 . . . . 64.53 112.711 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.486 ' HB3' ' HB2' ' A' ' 20' ' ' LYS . 80.1 t80 -75.58 -26.15 57.65 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.052 0.22 . . . . 73.12 111.218 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.96 -29.04 66.06 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.94 0.336 . . . . 70.5 111.341 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.38 -23.44 61.11 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 123.456 0.472 . . . . 75.32 111.811 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -93.75 -69.06 0.77 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.639 0.376 . . . . 71.31 111.808 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.94 -135.02 1.46 Allowed 'General case' 0 C--N 1.352 0.709 0 C-N-CA 124.741 1.216 . . . . 72.24 110.709 -172.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.4 mm -97.1 98.0 6.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.002 -1.111 . . . . 74.52 108.002 172.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -117.45 -9.6 10.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.334 -0.848 . . . . 71.22 111.794 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.94 -29.04 3.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.462 0.542 . . . . 74.14 112.462 -173.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.81 17.51 6.57 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.901 0.704 . . . . 73.13 112.901 -174.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -82.97 -26.81 30.98 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.011 -0.54 . . . . 73.0 110.57 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -74.82 -20.19 59.88 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.819 0.674 . . . . 74.42 112.819 -174.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.4 m -88.08 -0.19 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.213 0.449 . . . . 71.21 112.213 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.2 mt -86.53 2.72 47.05 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.043 0.449 . . . . 74.41 111.182 -179.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -80.43 -17.87 50.5 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.532 -0.758 . . . . 54.31 109.985 172.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -80.17 174.63 11.41 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.012 -0.54 . . . . 74.24 110.996 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -73.18 111.55 8.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.147 -0.479 . . . . 65.52 109.882 -177.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 44.0 p-80 -120.17 114.13 21.48 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.744 0.783 . . . . 74.41 112.436 -170.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -105.98 173.16 6.43 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.893 -1.049 . . . . 75.41 110.175 173.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.9 p80 -121.24 117.1 26.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.373 0.606 . . . . 54.31 109.972 171.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.761 -0.654 . . . . 70.24 109.932 179.33 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 N--CA 1.477 0.922 0 CA-C-O 120.869 0.366 . . . . 72.3 110.115 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.624 HD12 ' HD2' ' A' ' 48' ' ' LYS . 11.0 pt -127.07 166.94 22.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.435 -0.802 . . . . 74.24 110.466 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.408 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 18.2 mmt180 -103.91 112.99 26.2 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.548 0.689 . . . . 71.4 111.104 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.8 mt -91.83 148.31 22.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.271 -1.332 . . . . 35.33 110.401 -179.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.8 p -87.33 169.8 11.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.163 -0.471 . . . . 63.25 110.836 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.404 HG12 ' HB1' ' A' ' 64' ' ' ALA . 50.5 mt -70.8 -22.49 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.743 -0.662 . . . . 71.43 109.803 177.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.42 -55.04 27.54 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.136 0.575 . . . . 74.33 111.22 174.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.01 -37.33 69.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.675 -0.693 . . . . 72.32 111.912 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.74 ' HA ' HD12 ' A' ' 12' ' ' LEU . 7.6 m -74.75 -27.82 60.51 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.402 -0.363 . . . . 64.3 111.89 -179.167 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -65.25 -38.22 89.66 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 122.198 -0.314 . . . . 74.04 110.524 174.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.531 ' HA ' HD12 ' A' ' 14' ' ' ILE . 21.3 tp -70.65 -32.55 69.88 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.619 0.574 . . . . 63.3 111.023 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 9' ' ' THR . 86.9 mt -61.91 -40.92 97.12 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.868 -0.605 . . . . 61.54 111.178 171.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 t -71.5 -27.55 63.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.312 0.645 . . . . 64.4 112.093 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 11' ' ' LEU . 75.6 mt -63.79 -37.5 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.395 0.678 . . . . 73.12 111.116 176.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -94.88 -87.75 0.26 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 119.584 -0.246 . . . . 74.54 110.449 175.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.421 ' HA ' HD21 ' A' ' 23' ' ' LEU . 58.2 t30 50.28 66.46 1.14 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.809 1.244 . . . . 73.32 111.798 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -85.49 -75.87 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.564 -0.744 . . . . 72.43 110.806 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -141.8 66.62 0.48 Allowed Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 111.437 -0.665 . . . . 33.12 111.437 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.68 -160.11 37.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.411 -0.424 . . . . 74.22 112.117 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.629 ' HE2' HG22 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -70.4 -29.4 66.01 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.567 0.58 . . . . 72.12 112.567 -174.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.9 mtt180 -71.5 -44.78 64.06 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 123.165 0.291 . . . . 54.4 110.434 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.69 -27.34 68.11 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 123.552 0.533 . . . . 71.13 112.828 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' A' ' 23' ' ' LEU . 1.2 mm? -71.41 -56.44 5.95 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-O 119.403 -0.332 . . . . 70.21 111.884 172.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 97.6 mtp -72.2 -35.99 69.09 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.574 0.583 . . . . 61.41 112.574 -169.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.3 -45.67 86.96 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.121 0.568 . . . . 63.32 112.202 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -78.36 -24.44 46.45 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.166 0.432 . . . . 65.43 112.166 -177.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.782 HG23 ' HB1' ' A' ' 42' ' ' ALA . 20.8 mt -67.01 -46.52 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 119.59 -0.243 . . . . 73.31 110.648 173.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -66.2 -33.73 76.43 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.501 0.556 . . . . 70.11 112.501 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.01 -36.17 59.25 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 123.458 0.473 . . . . 61.12 112.145 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.722 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.28 21.07 18.06 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.966 0.728 . . . . 74.01 112.966 -172.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HB2' ' HD3' ' A' ' 32' ' ' PRO . 79.1 mt -52.27 -53.21 55.17 Favored Pre-proline 0 CA--C 1.56 1.347 0 N-CA-C 113.402 0.889 . . . . 74.34 113.402 173.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.481 ' HD3' ' HB2' ' A' ' 31' ' ' LEU . 7.3 Cg_exo -76.33 -13.14 18.84 Favored 'Trans proline' 0 C--N 1.381 2.255 0 C-N-CA 121.982 1.788 . . . . 75.53 113.681 177.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.722 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.8 m-85 -81.49 -21.98 38.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.86 0.362 . . . . 62.52 110.742 177.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.0 mtm -84.52 163.82 19.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.863 -0.608 . . . . 63.54 110.63 171.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -85.37 177.78 7.68 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.83 -0.623 . . . . 73.11 110.518 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -42.71 -52.1 5.05 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 126.232 1.813 . . . . 75.44 114.078 -176.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -68.55 -50.59 50.71 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.301 0.64 . . . . 74.15 111.441 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 62.6 mtt -70.46 -27.43 64.23 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 124.006 0.816 . . . . 35.21 112.769 -172.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -65.84 -50.88 63.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.526 0.73 . . . . 73.43 111.12 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.16 -32.4 63.11 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.801 0.667 . . . . 72.55 112.801 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -69.17 -28.73 66.67 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.164 0.585 . . . . 75.25 110.777 178.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.782 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -66.12 -36.23 82.61 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 112.655 0.613 . . . . 64.53 112.655 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.86 -33.07 74.04 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 123.398 0.436 . . . . 74.14 111.591 176.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.423 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 79.4 mtp180 -68.32 -39.12 82.1 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.646 -0.706 . . . . 75.32 110.81 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 49' ' ' ILE . 6.9 m -73.65 -35.06 65.22 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.745 -0.661 . . . . 70.03 111.064 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 79.3 mt -62.47 -38.14 88.67 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.566 0.346 . . . . 73.2 111.534 173.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.61 -15.32 62.74 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.338 -0.847 . . . . 44.32 112.43 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.624 ' HD2' HD12 ' A' ' 2' ' ' ILE . 46.5 mmtm -88.36 -42.03 12.46 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.505 0.558 . . . . 62.24 112.505 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.629 HG22 ' HE2' ' A' ' 20' ' ' LYS . 6.5 mt -83.26 -25.26 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 117.838 0.29 . . . . 65.3 111.736 -172.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.1 -45.84 73.01 Favored Pre-proline 0 CA--C 1.552 1.019 0 N-CA-C 113.801 1.037 . . . . 75.31 113.801 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -76.0 -6.26 17.19 Favored 'Trans proline' 0 C--N 1.376 2.011 0 CA-C-N 122.194 1.819 . . . . 71.24 114.212 174.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.3 mt -90.96 162.38 14.77 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.033 0.444 . . . . 74.23 109.986 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.427 HG22 ' HG3' ' A' ' 56' ' ' GLU . 14.5 t -93.33 174.64 7.11 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 109.495 -0.558 . . . . 55.23 109.495 170.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.517 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 12.8 pt-20 -68.2 -26.89 65.96 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.202 0.601 . . . . 72.4 112.173 -179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -74.34 -40.53 62.11 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 122.242 0.217 . . . . 73.22 110.863 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.427 ' HG3' HG22 ' A' ' 53' ' ' THR . 48.8 mt-10 -66.67 -37.23 84.35 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.46 0.475 . . . . 52.45 112.254 -177.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -70.11 -36.26 74.71 Favored 'General case' 0 C--O 1.217 -0.653 0 O-C-N 123.299 0.374 . . . . 73.24 110.742 175.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.99 -24.99 60.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.27 0.471 . . . . 74.44 112.27 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.15 -29.99 64.58 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.364 0.265 . . . . 74.42 111.17 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.2 mt -84.86 -43.57 14.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.126 -0.488 . . . . 70.12 110.231 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.85 -110.37 0.56 Allowed 'General case' 0 C--N 1.347 0.491 0 O-C-N 125.341 1.651 . . . . 73.1 110.994 -173.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 46.6 mm -110.93 94.95 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 106.926 -1.509 . . . . 63.2 106.926 168.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -80.32 -62.59 1.63 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.33 -1.305 . . . . 73.32 111.547 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.604 ' H ' HG21 ' A' ' 9' ' ' THR . . . -126.2 86.27 2.5 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.149 0.5 . . . . 75.31 111.438 -178.174 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -145.71 -5.34 0.64 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 73.04 111.109 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -90.86 25.17 2.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.494 0.664 . . . . 64.33 110.764 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -107.29 -30.78 8.52 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.403 -0.817 . . . . 71.14 109.713 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 m -105.96 32.78 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.479 -0.782 . . . . 55.31 112.314 -171.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.434 HD23 ' H ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -78.19 -4.79 49.43 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.867 -0.606 . . . . 61.23 111.214 177.63 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -86.54 -1.14 57.37 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.388 0.675 . . . . 72.12 110.788 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -68.03 103.05 1.41 Allowed 'General case' 0 C--N 1.343 0.326 0 CA-C-O 121.306 0.574 . . . . 74.41 109.91 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -141.36 114.94 8.95 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.96 -1.018 . . . . 75.24 108.483 -173.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -77.54 110.85 12.68 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 122.41 1.1 . . . . 50.44 111.097 -175.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 36.6 t-80 -149.88 91.75 1.82 Allowed 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 106.669 -1.604 . . . . 74.15 106.669 169.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -89.14 67.6 8.02 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 114.847 -1.069 . . . . 54.53 109.44 -175.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 63.4 m80 . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 124.837 1.255 . . . . 73.43 112.089 -176.788 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.481 1.109 0 CA-C-O 120.809 0.338 . . . . 22.11 110.443 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.697 HD13 ' HB2' ' A' ' 48' ' ' LYS . 10.2 tt -123.98 138.6 53.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 109.307 -0.627 . . . . 71.13 109.307 170.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -91.19 121.06 32.64 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.33 -0.395 . . . . 64.24 111.621 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mp -135.06 -176.17 4.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.839 -0.619 . . . . 71.51 110.65 177.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.01 171.38 8.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 116.068 -0.515 . . . . 64.24 110.37 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.87 HG21 ' HB2' ' A' ' 67' ' ' GLU . 17.0 mm -57.84 -47.15 86.86 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.627 0 C-N-CA 123.78 0.832 . . . . 72.55 111.517 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -60.21 -36.04 76.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.567 0.747 . . . . 62.24 112.64 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.576 ' HG2' HD11 ' A' ' 41' ' ' LEU . 32.7 mt-10 -75.17 -41.09 58.85 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.933 0.493 . . . . 72.15 111.495 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.424 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.8 m -76.64 -28.0 55.87 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 116.18 -0.464 . . . . 62.21 111.639 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -71.63 -26.21 62.47 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.097 0.559 . . . . 72.34 111.267 173.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.532 HD21 ' HA ' ' A' ' 42' ' ' ALA . 50.6 tp -66.21 -31.01 71.58 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 122.628 0.371 . . . . 74.05 111.204 173.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.511 HD22 HD21 ' A' ' 23' ' ' LEU . 83.7 mt -60.36 -32.5 71.34 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.248 -0.433 . . . . 33.22 111.355 173.417 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -69.47 -25.58 64.15 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.286 0.635 . . . . 72.2 112.329 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.9 mm -69.18 -44.96 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 122.899 0.48 . . . . 73.13 111.125 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.426 ' HB2' HD12 ' A' ' 23' ' ' LEU . 82.9 m-85 -120.23 19.29 12.2 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.982 0.734 . . . . 71.12 112.982 -172.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 0.2 OUTLIER -67.88 106.98 2.47 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.077 0.465 . . . . 64.23 109.999 178.716 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -145.07 96.38 2.84 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.894 -1.048 . . . . 75.44 108.279 -178.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.46 42.68 32.98 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 120.697 -0.763 . . . . 55.55 111.901 -173.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.52 -138.46 21.72 Favored Glycine 0 N--CA 1.447 -0.589 0 O-C-N 123.833 0.373 . . . . 63.22 112.474 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.741 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 2.2 pptp? -95.72 -7.96 35.88 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.796 0.351 . . . . 74.55 111.253 -177.535 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -63.92 -60.28 3.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.801 -0.636 . . . . 73.51 110.318 174.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -27.93 71.58 Favored Glycine 0 C--O 1.223 -0.579 0 CA-C-N 115.702 -0.681 . . . . 63.41 112.747 176.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.741 ' HB3' ' HA ' ' A' ' 20' ' ' LYS . 57.3 tp -59.98 -44.35 94.55 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.397 0.679 . . . . 73.33 111.406 175.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 46.5 mtt -64.16 -46.99 81.6 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.232 0.456 . . . . 42.13 112.232 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -63.79 -41.68 97.89 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 123.762 0.664 . . . . 74.22 111.339 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.415 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 20.5 m-80 -71.83 -38.05 70.23 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 112.508 0.559 . . . . 72.42 112.508 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.5 mt -70.04 -44.52 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 119.301 -0.38 . . . . 72.15 111.563 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -65.65 -35.58 81.21 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.283 0.475 . . . . 54.14 112.283 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.48 -29.99 64.13 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 123.207 0.317 . . . . 75.54 111.578 177.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.75 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -99.98 16.41 24.01 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.519 0.563 . . . . 62.44 112.519 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.2 mt -67.28 -44.81 48.9 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.618 -0.706 . . . . 53.14 112.065 172.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.8 12.61 0.69 Allowed 'Trans proline' 0 C--N 1.377 2.065 0 CA-C-N 121.759 1.664 . . . . 35.01 113.911 169.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.75 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.4 m-85 -124.47 -154.92 0.64 Allowed 'General case' 0 C--O 1.239 0.517 0 C-N-CA 123.72 0.808 . . . . 73.55 109.222 177.117 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 70.8 mtm 67.47 -94.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.297 1.439 . . . . 74.3 112.796 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -174.74 147.58 1.04 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.479 -1.675 . . . . 72.12 106.479 -166.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.04 -38.32 79.09 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 118.403 0.547 . . . . 72.42 112.168 -177.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.76 -45.25 75.44 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.18 0.514 . . . . 74.02 110.705 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 18.4 ttp -73.04 -24.34 60.7 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.302 -0.863 . . . . 64.21 111.844 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -69.22 -39.73 78.4 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.839 0.456 . . . . 60.54 111.626 173.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -61.72 -36.34 80.66 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.062 0.458 . . . . 75.11 111.188 173.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.576 HD11 ' HG2' ' A' ' 8' ' ' GLU . 27.2 tp -71.36 -39.06 71.49 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 115.285 -0.87 . . . . 72.31 111.04 176.215 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.532 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -66.41 -32.35 73.68 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.252 0.621 . . . . 70.24 112.322 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -65.39 -44.82 86.32 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.199 -0.91 . . . . 74.42 111.992 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -80.34 -22.11 41.79 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.88 0.696 . . . . 74.31 112.88 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.508 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 60.7 m -84.24 -27.29 28.03 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 120.816 0.341 . . . . 72.32 110.868 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.422 HD23 HD11 ' A' ' 49' ' ' ILE . 28.9 mt -66.99 -33.73 76.22 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 122.101 -0.375 . . . . 73.31 111.709 168.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.52 -20.53 60.63 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 123.584 0.553 . . . . 44.53 112.239 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.697 ' HB2' HD13 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -87.18 -25.76 23.89 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 119.484 -0.293 . . . . 63.23 111.6 178.624 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.473 HG22 HD12 ' A' ' 52' ' ' LEU . 15.4 pt -92.66 -14.76 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 112.395 0.517 . . . . 74.41 112.395 178.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.19 -48.01 97.71 Favored Pre-proline 0 CA--C 1.554 1.133 0 N-CA-C 114.639 1.348 . . . . 74.21 114.639 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.98 -1.32 11.15 Favored 'Trans proline' 0 C--N 1.38 2.215 0 CA-C-N 121.96 1.736 . . . . 62.34 113.98 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.473 HD12 HG22 ' A' ' 49' ' ' ILE . 61.4 mt -86.83 149.11 25.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.202 -0.666 . . . . 72.15 109.202 177.174 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 t -95.02 178.23 5.62 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 108.954 -0.758 . . . . 75.24 108.954 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -74.19 -38.79 63.53 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.746 0.308 . . . . 73.15 111.553 -172.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -72.08 -29.57 64.25 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.042 -0.526 . . . . 73.02 111.021 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -71.64 -30.94 66.31 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.208 0.603 . . . . 73.0 111.18 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -74.53 -28.22 60.87 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 110.159 -0.311 . . . . 72.52 110.159 173.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.1 -22.22 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.967 0.349 . . . . 71.05 111.7 177.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -71.23 -37.57 72.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.938 -0.574 . . . . 71.21 111.688 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.43 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 13.2 mt -85.31 -53.01 5.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.142 -0.481 . . . . 74.11 110.759 -176.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.53 -109.17 0.47 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.742 1.617 . . . . 53.23 111.136 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 47.3 mm -121.55 107.39 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 107.779 -1.193 . . . . 75.32 107.779 173.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.43 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 1.2 m-85 -97.03 -73.7 0.59 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.229 -0.441 . . . . 74.54 111.775 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.557 ' HB1' ' HA ' ' A' ' 6' ' ' ILE . . . -89.98 102.14 14.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.304 0.573 . . . . 62.41 111.111 -175.279 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -149.72 -179.15 6.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.139 -0.937 . . . . 71.43 108.966 178.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.8 t70 75.35 -31.14 0.2 Allowed 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 124.877 1.271 . . . . 71.05 113.331 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.87 ' HB2' HG21 ' A' ' 6' ' ' ILE . 36.7 mm-40 -70.57 -19.92 62.83 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.385 0.674 . . . . 75.44 111.781 -178.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.6 m -87.61 3.68 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.848 -0.614 . . . . 70.24 111.728 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 77.1 mt -99.23 -37.07 9.44 Favored 'General case' 0 C--O 1.226 -0.161 0 N-CA-C 110.097 -0.334 . . . . 73.12 110.097 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -67.34 -55.45 13.79 Favored 'General case' 0 C--N 1.344 0.364 0 N-CA-C 108.565 -0.902 . . . . 70.12 108.565 172.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -70.33 139.43 52.02 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.327 -0.851 . . . . 72.43 109.337 175.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 76.7 123.4 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 O-C-N 125.071 1.482 . . . . 74.43 110.48 -168.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -85.25 147.56 26.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.869 -1.06 . . . . 64.31 111.142 -173.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 50.8 p-80 -69.7 158.66 34.95 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.408 -0.815 . . . . 71.34 111.748 -175.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -122.5 99.42 6.4 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.333 -0.618 . . . . 61.52 109.333 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.4 t60 . . . . . 0 CA--C 1.536 0.415 0 CA-C-N 116.206 -0.452 . . . . 70.42 109.957 -179.424 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ttt . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 110.095 -0.335 . . . . 51.31 110.095 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.722 HD11 ' HG3' ' A' ' 48' ' ' LYS . 20.8 pt -81.31 154.46 4.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 N-CA-C 109.51 -0.552 . . . . 75.42 109.51 172.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 3' ' ' ARG . 5.3 mpt_? -102.17 104.23 14.8 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.695 -0.684 . . . . 72.12 109.628 -170.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.477 HD11 ' HD2' ' A' ' 48' ' ' LYS . 19.0 mt -85.51 165.45 17.11 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.766 -1.107 . . . . 52.23 109.166 178.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -82.64 172.6 12.76 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 109.356 -0.609 . . . . 55.2 109.356 176.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.794 HG21 ' HB2' ' A' ' 67' ' ' GLU . 18.8 mm -69.65 -22.31 25.07 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.557 -0.747 . . . . 73.22 111.01 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.31 -40.21 85.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.632 0.373 . . . . 72.4 111.689 175.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -65.91 -40.84 91.85 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.271 0.357 . . . . 74.31 111.213 175.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.492 HG21 ' H ' ' A' ' 64' ' ' ALA . 6.4 m -70.14 -34.77 73.46 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.958 -0.564 . . . . 70.51 111.467 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.485 ' O ' HG13 ' A' ' 14' ' ' ILE . 13.0 t30 -71.31 -30.82 66.69 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.659 0.784 . . . . 73.54 111.725 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.433 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 22.8 tp -62.29 -40.07 95.06 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 123.411 0.444 . . . . 74.11 111.086 176.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.401 HD13 ' HE1' ' A' ' 57' ' ' TYR . 66.1 mt -70.91 -32.47 69.41 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.336 -0.847 . . . . 73.31 111.065 177.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.0 t -70.62 -26.22 63.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.514 0.726 . . . . 75.51 112.435 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 10' ' ' ASN . 97.1 mt -61.77 -48.47 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 122.864 0.466 . . . . 54.25 111.319 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -98.0 -76.18 0.53 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.627 -0.261 . . . . 55.33 110.803 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.705 ' HA ' HD21 ' A' ' 23' ' ' LEU . 15.8 t-20 53.65 81.13 0.1 Allowed 'General case' 0 N--CA 1.474 0.739 0 O-C-N 124.925 1.391 . . . . 74.12 111.7 -177.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -102.57 -95.2 0.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.713 -0.395 . . . . 71.53 111.316 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.535 ' H ' ' HA3' ' A' ' 22' ' ' GLY . . . -118.59 82.35 0.33 Allowed Glycine 0 CA--C 1.501 -0.806 0 C-N-CA 120.561 -0.828 . . . . 62.13 111.687 -177.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.06 43.06 Favored Glycine 0 C--O 1.226 -0.379 0 N-CA-C 111.598 -0.601 . . . . 53.41 111.598 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.408 ' HD3' HG22 ' A' ' 49' ' ' ILE . 2.7 pptp? -89.15 -18.2 27.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.518 0.159 . . . . 73.25 110.939 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 mtt85 -66.39 -51.15 60.0 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 123.424 0.453 . . . . 75.43 110.35 173.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.535 ' HA3' ' H ' ' A' ' 18' ' ' GLY . . . -63.89 -29.16 74.01 Favored Glycine 0 C--N 1.339 0.731 0 O-C-N 123.966 0.791 . . . . 45.44 113.051 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.705 HD21 ' HA ' ' A' ' 16' ' ' ASN . 2.4 mm? -67.9 -51.86 43.04 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-O 118.656 -0.688 . . . . 72.35 111.275 173.133 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.602 ' HG2' HD22 ' A' ' 46' ' ' LEU . 52.8 mtt -63.81 -42.02 97.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.97 0.73 . . . . 63.43 112.97 -175.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -67.78 -38.09 82.93 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.305 0.483 . . . . 74.03 112.305 -177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -79.79 -33.11 40.8 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.277 0.473 . . . . 73.34 112.277 178.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.5 mt -69.22 -47.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 118.908 -0.567 . . . . 53.53 111.374 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.505 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 35.1 m-80 -66.62 -31.13 71.63 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.368 0.507 . . . . 74.22 112.368 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.45 -31.26 60.25 Favored 'General case' 0 N--CA 1.464 0.248 0 O-C-N 123.177 0.298 . . . . 74.21 111.721 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.714 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.57 18.15 22.5 Favored 'General case' 0 C--O 1.223 -0.31 0 N-CA-C 112.689 0.626 . . . . 71.23 112.689 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.505 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 52.5 mt -55.88 -49.31 93.66 Favored Pre-proline 0 CA--C 1.554 1.106 0 N-CA-C 114.121 1.156 . . . . 64.2 114.121 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -79.99 0.14 10.24 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 121.912 1.742 . . . . 62.42 113.409 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.714 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.6 m-85 -97.73 -20.83 17.33 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.197 0.199 . . . . 74.53 111.397 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.3 mtt -75.08 -81.22 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.273 0.358 . . . . 72.45 111.234 -179.144 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.622 ' HB3' ' HB2' ' A' ' 38' ' ' MET . 34.9 t70 -179.08 161.59 1.15 Allowed 'General case' 0 C--N 1.338 0.079 0 N-CA-C 106.812 -1.551 . . . . 64.01 106.812 -170.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.54 -47.04 85.65 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.827 0.451 . . . . 75.04 111.326 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -76.88 -34.31 57.78 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.876 -0.602 . . . . 74.11 110.447 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.622 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 3.6 tpt -72.25 -25.48 61.64 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 123.824 0.703 . . . . 65.25 111.486 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.42 ' HG3' ' HB3' ' A' ' 31' ' ' LEU . 13.0 ttp180 -70.63 -40.55 73.05 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 122.417 0.287 . . . . 74.34 110.727 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.51 -30.12 64.22 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.246 0.546 . . . . 71.21 110.587 178.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.15 -34.96 71.47 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 115.067 -0.969 . . . . 63.43 110.639 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.433 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -65.14 -40.03 93.82 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 116.164 -0.471 . . . . 65.13 111.574 175.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -68.46 -30.06 68.84 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.623 0.577 . . . . 61.0 111.553 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 tpp180 -71.07 -46.97 60.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.09 0.556 . . . . 74.1 111.552 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 49' ' ' ILE . 11.2 m -70.62 -44.04 68.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.112 -0.494 . . . . 73.13 111.302 -176.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.602 HD22 ' HG2' ' A' ' 24' ' ' MET . 52.8 mt -70.48 -27.28 64.09 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.671 0.619 . . . . 73.23 112.671 -177.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.49 -29.15 70.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.754 0.311 . . . . 72.51 111.704 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.722 ' HG3' HD11 ' A' ' 2' ' ' ILE . 14.9 tmtt? -81.53 -33.22 31.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.196 -0.457 . . . . 74.1 110.51 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.52 ' HA ' HD12 ' A' ' 52' ' ' LEU . 11.4 mt -90.8 -11.51 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-O 120.835 0.35 . . . . 70.22 111.458 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.78 -46.34 99.57 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 113.889 1.07 . . . . 74.32 113.889 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -75.66 -6.45 17.62 Favored 'Trans proline' 0 C--N 1.378 2.095 0 CA-C-N 121.76 1.664 . . . . 64.41 113.542 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.52 HD12 ' HA ' ' A' ' 49' ' ' ILE . 65.3 mt -90.11 158.22 17.39 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.603 -0.517 . . . . 61.54 109.603 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 55' ' ' ASN . 8.7 t -112.74 -167.37 1.18 Allowed 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.19 -0.67 . . . . 72.35 109.19 171.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.41 -29.16 69.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.122 0.569 . . . . 74.53 112.129 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.491 ' H ' HG23 ' A' ' 53' ' ' THR . 21.1 t-20 -65.0 -46.23 82.25 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.745 0.653 . . . . 74.13 110.348 177.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 2.4 mp0 -69.2 -28.79 66.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.996 0.739 . . . . 72.02 112.996 -178.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.401 ' HE1' HD13 ' A' ' 12' ' ' LEU . 77.9 t80 -72.45 -37.42 68.54 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 120.842 -0.343 . . . . 73.53 110.27 175.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.27 -14.04 60.48 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.436 0.532 . . . . 72.23 112.436 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 14.0 mm-40 -63.21 -31.55 72.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.084 0.469 . . . . 75.35 110.389 168.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.4 mt -89.59 -61.76 1.62 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.498 -0.774 . . . . 55.42 109.986 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.3 45.73 26.64 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 124.766 1.291 . . . . 53.12 112.495 178.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 40.9 mm 66.72 95.92 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 C-N-CA 124.796 1.238 . . . . 73.0 110.151 -174.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -85.21 -56.91 3.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.773 -1.103 . . . . 55.03 112.09 -171.055 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.492 ' H ' HG21 ' A' ' 9' ' ' THR . . . -114.9 -97.35 0.45 Allowed 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.934 -0.575 . . . . 73.13 111.75 -170.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.53 -33.31 0.24 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.152 1.781 . . . . 53.23 114.848 176.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.502 ' HA ' HD12 ' A' ' 69' ' ' LEU . 3.5 p30 -75.8 -17.53 59.83 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.916 0.71 . . . . 73.3 112.916 -171.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.794 ' HB2' HG21 ' A' ' 6' ' ' ILE . 29.9 mp0 -64.25 -35.96 82.52 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.386 0.674 . . . . 75.42 112.298 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.1 m -91.99 -1.69 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 111.812 0.301 . . . . 61.12 111.812 178.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.502 HD12 ' HA ' ' A' ' 66' ' ' ASP . 84.9 mt -94.14 -58.27 2.28 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.582 -0.281 . . . . 73.4 110.495 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -151.94 -55.25 0.13 Allowed 'General case' 0 C--O 1.236 0.369 0 O-C-N 123.551 0.532 . . . . 74.13 110.172 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.738 ' HB2' ' HA ' ' A' ' 67' ' ' GLU . 49.4 t60 62.64 51.34 3.17 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 124.722 1.264 . . . . 65.4 111.041 176.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -99.48 84.97 3.06 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.787 -0.642 . . . . 74.22 109.889 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.5 t60 52.84 74.49 0.29 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.192 1.397 . . . . 72.43 111.199 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -80.45 146.5 31.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.434 -0.803 . . . . 72.12 111.38 -173.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 32.2 m80 -94.2 90.08 6.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.847 -0.615 . . . . 72.42 110.122 -175.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 . . . . . 0 N--CA 1.482 1.127 0 O-C-N 124.575 1.172 . . . . 65.05 111.279 -178.86 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.554 ' HA ' HD21 ' A' ' 60' ' ' LEU . 98.7 mmm . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 110.232 -0.284 . . . . 61.32 110.232 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.3 tt -148.73 140.78 17.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 109.013 -0.736 . . . . 73.15 109.013 175.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.496 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 9.4 mmt-85 -87.4 106.27 17.84 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.472 0.653 . . . . 72.15 110.964 178.272 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.477 HD22 ' HZ2' ' A' ' 48' ' ' LYS . 96.6 mt -114.12 165.58 12.51 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-N 114.699 -1.137 . . . . 73.51 110.802 -179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 153.13 27.16 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.778 -0.647 . . . . 35.25 109.979 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.41 -34.18 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.527 0.331 . . . . 74.32 110.865 176.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.1 -38.56 88.52 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.009 0.524 . . . . 74.41 111.4 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 36.9 mt-10 -70.42 -37.6 74.44 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 117.486 0.13 . . . . 72.44 111.31 178.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.594 ' HA ' HD12 ' A' ' 12' ' ' LEU . 5.9 m -74.81 -29.51 61.11 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 123.485 0.49 . . . . 64.32 111.369 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.465 ' O ' HG13 ' A' ' 14' ' ' ILE . 29.2 t-20 -70.92 -35.88 72.45 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.492 -0.322 . . . . 54.33 110.422 172.237 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.6 tp -65.95 -34.42 78.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.582 0.753 . . . . 42.45 110.882 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.78 ' HA ' HD11 ' A' ' 23' ' ' LEU . 95.6 mt -62.12 -39.99 94.38 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.514 -0.766 . . . . 62.11 110.831 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.3 t -70.41 -31.39 68.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.058 0.543 . . . . 34.41 112.27 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ASN . 77.4 mt -68.77 -45.21 81.37 Favored 'Isoleucine or valine' 0 C--N 1.347 0.463 0 CA-C-O 120.908 0.385 . . . . 75.12 110.731 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -108.33 23.62 14.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.324 0.49 . . . . 75.23 112.324 -172.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 65.9 t30 -82.41 114.36 20.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.888 0.375 . . . . 65.21 110.221 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.32 -76.27 0.6 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.48 -0.782 . . . . 73.5 109.534 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.89 61.66 0.6 Allowed Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.961 -0.856 . . . . 75.43 110.961 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.6 -149.22 21.62 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.33 -0.462 . . . . 71.35 112.348 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.516 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -78.87 -15.26 58.57 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 111.789 0.292 . . . . 74.14 111.789 -176.489 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -68.25 -46.35 70.73 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 109.153 -0.684 . . . . 61.43 109.153 172.133 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.68 -35.54 91.35 Favored Glycine 0 C--O 1.216 -0.98 0 O-C-N 124.025 0.828 . . . . 72.35 113.217 172.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.78 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.7 mm? -64.05 -46.62 83.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 117.117 0.458 . . . . 72.14 112.097 176.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 48.9 mtt -67.8 -42.43 81.62 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.952 0.352 . . . . 74.42 111.952 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 27.5 mm-40 -70.27 -44.05 69.23 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 112.319 0.488 . . . . 71.21 112.319 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -74.56 -31.3 62.05 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.47 0.544 . . . . 74.25 112.47 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 45.3 mt -72.6 -46.71 53.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 119.16 -0.448 . . . . 65.43 110.911 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -68.15 -25.26 65.18 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.693 0.627 . . . . 72.5 112.693 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.07 -26.39 36.33 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 111.469 0.174 . . . . 63.45 111.469 177.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.3 5.48 39.97 Favored 'General case' 0 C--O 1.209 -1.04 0 N-CA-C 112.689 0.625 . . . . 73.11 112.689 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 64.5 mt -60.6 -33.38 14.41 Favored Pre-proline 0 CA--C 1.56 1.351 0 N-CA-C 114.498 1.296 . . . . 74.14 114.498 176.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 31' ' ' LEU . 17.0 Cg_endo -60.46 -22.82 73.13 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.142 1.894 . . . . 75.32 114.283 166.313 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -105.12 -140.15 0.37 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.057 0.943 . . . . 74.54 109.181 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 86.0 mtp 73.31 160.09 0.23 Allowed 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.834 1.654 . . . . 75.24 113.194 172.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.49 148.01 47.21 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.05 -1.093 . . . . 71.25 108.05 168.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -67.23 -28.14 67.81 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 118.661 0.664 . . . . 75.24 112.159 -178.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.35 -46.09 77.97 Favored 'General case' 0 C--O 1.215 -0.757 0 O-C-N 123.481 0.488 . . . . 54.14 110.671 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.6 mmt -75.28 -28.64 59.83 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 123.833 0.708 . . . . 74.3 112.549 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -75.01 -48.96 21.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.632 0.773 . . . . 72.23 111.503 -173.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.91 -28.18 62.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.326 -0.397 . . . . 75.12 111.8 177.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.1 tp -64.97 -38.89 92.46 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.899 -0.591 . . . . 71.1 110.551 171.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.94 -28.42 68.27 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.355 1.062 . . . . 74.43 112.655 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -60.17 -39.54 86.82 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 123.671 0.607 . . . . 63.23 110.735 173.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -79.78 -30.58 40.67 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.063 -0.517 . . . . 71.0 111.336 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG12 ' A' ' 49' ' ' ILE . 73.2 m -70.45 -37.39 74.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.707 0.403 . . . . 53.22 111.189 -177.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.53 -31.9 63.92 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 111.406 0.15 . . . . 72.2 111.406 173.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.75 -31.54 71.53 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.666 0.604 . . . . 72.34 112.123 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.477 ' HZ2' HD22 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -87.31 -22.07 25.35 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.769 0.655 . . . . 61.11 112.769 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 45' ' ' THR . 35.6 pt -95.23 -12.29 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.389 0.541 . . . . 74.23 112.279 178.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.36 -44.13 87.11 Favored Pre-proline 0 CA--C 1.561 1.369 0 N-CA-C 113.828 1.047 . . . . 74.32 113.828 173.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -71.96 -10.97 26.94 Favored 'Trans proline' 0 C--N 1.38 2.207 0 CA-C-N 121.767 1.667 . . . . 54.05 113.868 170.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 86.4 mt -91.57 156.15 17.86 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.99 -0.374 . . . . 74.41 109.99 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p -92.43 -178.24 4.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.045 -0.525 . . . . 72.44 109.903 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -78.27 -25.01 46.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.35 -0.386 . . . . 74.53 111.018 175.861 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.87 -32.89 59.91 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 122.807 0.443 . . . . 75.31 111.799 173.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.62 -47.98 79.19 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.115 0.259 . . . . 71.43 110.641 173.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.85 -23.87 63.35 Favored 'General case' 0 C--O 1.21 -0.996 0 O-C-N 123.781 0.676 . . . . 64.0 111.931 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.8 -35.97 75.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.884 0.765 . . . . 51.21 111.616 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -82.68 -24.04 33.88 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.088 -0.506 . . . . 63.12 111.903 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.554 HD21 ' HA ' ' A' ' 1' ' ' MET . 57.1 mt -101.66 16.01 27.13 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.239 0.615 . . . . 41.02 112.263 -175.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -82.78 97.39 8.57 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.228 -0.442 . . . . 41.2 110.446 -176.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.444 HG23 ' HB3' ' A' ' 65' ' ' ALA . 5.3 mp 58.19 78.81 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 125.157 1.536 . . . . 65.4 110.391 179.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -100.05 -23.43 14.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.832 -1.076 . . . . 74.24 111.107 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.59 ' H ' HG21 ' A' ' 9' ' ' THR . . . -148.05 80.86 1.48 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.104 0.478 . . . . 73.34 111.048 -177.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.444 ' HB3' HG23 ' A' ' 62' ' ' ILE . . . -150.94 13.15 0.69 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.01 -0.541 . . . . 75.13 111.22 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -104.14 -4.12 23.56 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.99 0.367 . . . . 74.34 111.99 -174.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -82.45 -7.75 59.63 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.956 -0.566 . . . . 60.44 110.99 177.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.9 m -102.09 10.38 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 116.396 -0.365 . . . . 65.32 111.184 175.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 71.9 mt -82.21 162.21 22.46 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.515 -0.311 . . . . 71.43 110.967 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 67.42 19.58 10.03 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.195 1.398 . . . . 72.11 111.834 -174.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -90.13 -7.21 54.28 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.626 -0.879 . . . . 75.52 108.626 167.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -138.89 171.15 14.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.256 -1.338 . . . . 72.14 108.198 172.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 -112.43 138.84 48.6 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.426 -0.583 . . . . 70.43 109.426 171.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 21.1 t-80 -90.35 135.91 33.39 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.486 -0.561 . . . . 75.23 109.486 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -111.58 179.37 4.04 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.866 -0.606 . . . . 71.01 110.053 -177.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 . . . . . 0 CA--C 1.536 0.405 0 CA-C-N 116.113 -0.494 . . . . 52.32 110.319 175.162 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.4 ttp . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 109.701 -0.481 . . . . 72.24 109.701 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.585 HG23 HD21 ' A' ' 52' ' ' LEU . 45.3 pt -88.23 166.21 1.93 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-O 120.829 0.347 . . . . 73.11 110.964 178.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.72 117.47 34.45 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.6 -0.519 . . . . 75.1 109.6 175.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.578 ' H ' ' HZ ' ' A' ' 63' ' ' PHE . 66.0 mt -114.23 154.4 27.98 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.916 -1.038 . . . . 73.41 109.159 173.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 34.0 p -84.73 -177.25 6.54 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.481 0.178 . . . . 71.44 111.481 -178.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.762 HD13 ' HB1' ' A' ' 64' ' ' ALA . 15.7 mm -64.26 -36.42 77.03 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.361 -0.382 . . . . 74.22 110.171 177.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -69.03 -46.35 68.15 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.742 0.417 . . . . 75.51 111.546 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.544 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 43.9 mt-10 -68.35 -43.64 77.02 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.982 0.801 . . . . 71.24 111.399 -175.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 64' ' ' ALA . 9.1 m -74.56 -29.68 61.44 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 122.659 0.384 . . . . 41.02 111.747 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -64.75 -42.56 95.08 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.6 0.36 . . . . 63.01 110.8 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.515 HD21 ' HA ' ' A' ' 42' ' ' ALA . 7.0 tp -61.83 -41.8 98.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.99 0.916 . . . . 64.43 111.606 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.808 HD22 HD21 ' A' ' 23' ' ' LEU . 65.9 mt -68.64 -31.25 70.25 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 116.204 -0.453 . . . . 73.54 111.296 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.6 t -70.53 -24.3 62.79 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.609 0.764 . . . . 72.31 111.751 176.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.0 mt -78.03 -42.4 27.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 122.53 0.332 . . . . 73.32 110.717 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -106.78 11.64 29.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.602 0.593 . . . . 62.13 112.602 -173.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -58.45 103.23 0.14 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.385 1.074 . . . . 73.24 111.761 175.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -101.6 -75.65 0.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.373 -0.83 . . . . 63.11 110.223 177.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.92 74.45 0.44 Allowed Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.416 -0.674 . . . . 71.42 111.416 -175.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.79 -136.84 19.12 Favored Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 110.874 -0.89 . . . . 64.35 110.874 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.88 -23.11 18.89 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 120.55 0.214 . . . . 75.03 110.857 173.275 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -74.42 -49.91 20.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.791 -0.641 . . . . 72.4 110.371 -176.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.04 -29.94 75.98 Favored Glycine 0 C--N 1.337 0.585 0 O-C-N 123.457 0.473 . . . . 74.31 112.434 172.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.808 HD21 HD22 ' A' ' 12' ' ' LEU . 63.6 tp -61.68 -43.49 98.76 Favored 'General case' 0 C--O 1.218 -0.596 0 C-N-CA 123.275 0.63 . . . . 72.13 110.949 174.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.425 ' HG2' HD13 ' A' ' 46' ' ' LEU . 55.8 mtt -70.08 -40.21 75.15 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.245 0.341 . . . . 73.41 111.81 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.75 -39.59 93.89 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.374 0.421 . . . . 74.15 111.64 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -72.86 -40.27 65.81 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 115.946 -0.57 . . . . 73.14 110.921 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.422 ' HA ' ' HE1' ' A' ' 34' ' ' MET . 32.6 mt -67.38 -46.33 83.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 119.155 -0.45 . . . . 74.21 112.192 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -67.35 -25.24 65.89 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.098 0.777 . . . . 75.42 113.098 -176.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.89 -35.42 24.13 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.476 0.176 . . . . 70.24 111.476 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.532 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.45 16.07 22.86 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 113.078 0.77 . . . . 73.33 113.078 -172.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.8 mt -53.44 -51.18 78.15 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 114.373 1.249 . . . . 72.05 114.373 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.53 -23.52 57.36 Favored 'Trans proline' 0 C--N 1.38 2.22 0 CA-C-N 121.834 1.691 . . . . 74.13 113.409 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.532 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 15.0 m-85 -92.7 10.84 28.95 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.109 0.563 . . . . 73.52 111.127 -173.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 62.8 mtt -99.17 16.29 23.28 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.009 -0.541 . . . . 73.4 111.823 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.29 -77.05 0.06 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.956 1.302 . . . . 72.13 111.976 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.65 -53.91 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.199 0.6 . . . . 50.13 109.728 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -70.48 -36.07 73.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 123.682 0.614 . . . . 71.11 112.049 -172.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 16.2 mmt -74.36 -29.57 61.62 Favored 'General case' 0 C--O 1.213 -0.82 0 O-C-N 123.363 0.415 . . . . 72.43 111.461 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -70.9 -52.5 19.7 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.45 0.3 . . . . 74.42 111.584 -177.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -66.64 -36.21 82.01 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.818 -0.628 . . . . 64.21 111.395 -176.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.456 HD11 ' HG2' ' A' ' 8' ' ' GLU . 27.7 tp -70.57 -34.81 72.62 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.8 -0.636 . . . . 54.25 111.02 177.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.515 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -66.96 -37.78 84.89 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 112.611 0.597 . . . . 61.44 112.611 -177.405 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -73.17 -33.59 65.52 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.004 0.19 . . . . 64.04 111.43 178.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 44' ' ' ARG . 64.3 mtt180 -67.58 -43.11 81.36 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.518 0.511 . . . . 64.45 111.324 174.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 49' ' ' ILE . 21.8 m -76.53 -30.59 57.19 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.173 -0.467 . . . . 53.41 111.274 -177.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.425 HD13 ' HG2' ' A' ' 24' ' ' MET . 12.7 mt -69.98 -30.1 67.36 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 118.724 0.693 . . . . 72.34 112.035 175.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.54 -19.31 60.94 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.362 0.414 . . . . 72.14 111.291 173.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -88.76 -24.31 22.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.009 0.523 . . . . 74.33 111.365 177.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.508 HG23 HD12 ' A' ' 52' ' ' LEU . 15.4 mt -94.09 -8.53 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.322 0.582 . . . . 75.24 109.771 175.191 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.8 -41.48 77.49 Favored Pre-proline 0 CA--C 1.557 1.243 0 CA-C-O 118.026 -0.988 . . . . 71.23 113.509 174.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.47 1.71 8.5 Favored 'Trans proline' 0 C--N 1.381 2.278 0 CA-C-N 121.677 1.635 . . . . 75.23 114.124 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.585 HD21 HG23 ' A' ' 2' ' ' ILE . 54.0 mt -96.73 169.31 9.96 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.976 -0.379 . . . . 75.35 109.976 176.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 16.9 p -105.67 -170.64 1.77 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.013 -0.54 . . . . 72.41 109.798 168.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -23.35 44.74 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.767 -0.457 . . . . 73.4 109.767 171.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -66.23 -46.3 77.68 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.798 0.839 . . . . 61.11 109.52 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 17.6 mm-40 -67.18 -29.54 69.25 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.883 0.74 . . . . 75.51 112.986 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -74.73 -36.7 62.65 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 110.43 -0.211 . . . . 75.5 110.43 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.64 -14.98 60.39 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.156 0.428 . . . . 62.1 112.156 177.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.51 -42.96 82.0 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 122.191 0.196 . . . . 74.41 111.309 172.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.532 ' HB2' ' CD1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -86.45 -44.96 11.59 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 120.939 -0.304 . . . . 73.21 111.36 178.111 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.3 34.41 22.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.292 1.437 . . . . 65.1 114.44 166.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.3 mm 67.02 93.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 122.452 1.12 . . . . 73.12 109.904 -173.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.578 ' HZ ' ' H ' ' A' ' 4' ' ' LEU . 21.6 p90 -117.35 -2.58 11.55 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.084 -1.417 . . . . 65.21 111.592 -171.187 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.762 ' HB1' HD13 ' A' ' 6' ' ' ILE . . . -153.82 75.31 1.03 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.09 0.471 . . . . 71.31 111.527 -173.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -142.58 -0.15 1.24 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.397 -0.365 . . . . 64.03 111.068 177.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -80.86 -30.88 35.57 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.835 -0.621 . . . . 44.3 111.84 -171.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -82.41 -14.87 54.47 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.955 0.724 . . . . 72.43 112.955 -166.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.9 m -95.3 -3.24 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 111.749 0.277 . . . . 73.44 111.749 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 78.0 mt -114.8 -66.51 1.08 Allowed 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.253 -0.647 . . . . 74.23 109.253 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.695 ' HG2' ' H ' ' A' ' 75' ' ' HIS . 17.6 mt-10 -85.49 100.86 12.18 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 124.096 0.872 . . . . 74.34 108.718 178.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -116.51 -0.42 12.47 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.96 0.409 . . . . 71.21 111.559 -173.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -132.95 -59.16 0.9 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.921 -0.4 . . . . 64.23 109.921 177.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -133.18 -77.69 0.48 Allowed 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.899 -0.778 . . . . 62.15 108.899 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.1 m80 -140.05 143.65 36.47 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 109.416 -0.587 . . . . 62.31 109.416 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.695 ' H ' ' HG2' ' A' ' 70' ' ' GLU . 18.0 m170 65.11 177.56 0.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 125.129 1.372 . . . . 65.21 113.893 177.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.486 -0.779 . . . . 73.11 109.33 172.742 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ttt . . . . . 0 N--CA 1.476 0.846 0 N-CA-C 110.037 -0.357 . . . . 75.11 110.037 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.1 tt -83.01 120.29 34.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 108.488 -0.93 . . . . 74.22 108.488 169.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.461 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 10.2 tpt180 -90.03 111.47 22.58 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.308 -0.997 . . . . 65.43 108.308 -178.408 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.515 HD12 ' HE1' ' A' ' 63' ' ' PHE . 58.3 mt -81.49 142.55 32.8 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-N 114.898 -1.046 . . . . 65.43 110.623 -171.35 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.411 HG22 ' HG3' ' A' ' 8' ' ' GLU . 11.5 t -82.0 166.33 19.91 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.436 -0.802 . . . . 74.44 109.448 -174.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.514 HG22 HG13 ' A' ' 68' ' ' VAL . 21.9 mm -59.7 -33.06 50.85 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 O-C-N 123.663 0.602 . . . . 74.31 110.951 -177.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -70.6 -38.91 74.05 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.416 0.895 . . . . 73.31 113.416 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 48.4 mt-10 -68.17 -41.06 82.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.08 0.467 . . . . 72.51 110.889 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.685 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.7 m -74.61 -29.07 61.17 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.127 -0.942 . . . . 44.22 111.468 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -65.45 -38.81 90.95 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.399 0.68 . . . . 63.14 110.688 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.488 HD21 ' HA ' ' A' ' 42' ' ' ALA . 59.9 tp -65.34 -33.67 76.51 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.897 -0.592 . . . . 63.22 110.939 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 77.9 mt -66.07 -36.84 84.29 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.899 -0.591 . . . . 61.4 110.801 173.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 m -65.07 -23.63 67.22 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.288 0.477 . . . . 43.31 112.288 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.9 mt -85.19 -39.83 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 111.677 0.251 . . . . 54.13 111.677 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -120.24 0.81 10.72 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.804 1.409 . . . . 65.05 114.804 -166.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.484 ' HB2' HD23 ' A' ' 23' ' ' LEU . 4.3 t30 -86.65 121.78 29.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.448 0.567 . . . . 72.12 110.15 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.28 -14.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.843 -0.343 . . . . 71.44 111.873 173.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.56 61.9 0.32 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.483 -0.865 . . . . 61.34 113.573 -173.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.59 -161.53 51.49 Favored Glycine 0 C--O 1.225 -0.458 0 C-N-CA 121.442 -0.409 . . . . 63.25 113.372 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.926 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 54.5 tttt -75.06 -37.15 61.72 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 123.666 0.274 . . . . 75.41 111.432 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -65.23 -48.65 72.58 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-O 118.976 -0.535 . . . . 73.2 110.964 177.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.37 -35.92 91.72 Favored Glycine 0 C--O 1.222 -0.627 0 O-C-N 123.654 0.596 . . . . 53.33 112.858 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.484 HD23 ' HB2' ' A' ' 16' ' ' ASN . 2.4 tm? -62.02 -50.67 71.11 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.443 0.697 . . . . 65.14 110.591 176.278 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.893 ' HG2' HD22 ' A' ' 46' ' ' LEU . 40.7 mtt -71.66 -40.49 69.63 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 112.615 0.598 . . . . 70.1 112.615 -175.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.97 -35.43 78.36 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.294 0.372 . . . . 61.24 111.255 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -66.6 -48.61 68.97 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 123.358 0.411 . . . . 60.4 109.957 175.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.438 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 11.8 mt -61.88 -43.58 97.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 123.732 0.645 . . . . 64.13 112.255 -179.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -64.67 -36.46 84.34 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.467 0.543 . . . . 75.33 112.467 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.11 -27.47 54.05 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.547 -0.297 . . . . 55.44 111.696 178.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.531 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -102.8 15.02 30.52 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 112.864 0.69 . . . . 74.12 112.864 -175.233 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 79.2 mt -58.05 -47.47 98.81 Favored Pre-proline 0 CA--C 1.556 1.176 0 N-CA-C 113.681 0.993 . . . . 74.4 113.681 178.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -83.19 10.41 3.67 Favored 'Trans proline' 0 C--N 1.378 2.122 0 C-N-CA 121.849 1.699 . . . . 73.52 113.603 173.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.458 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 98.2 m-85 -109.81 -3.62 16.56 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.045 0.538 . . . . 74.42 110.217 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.1 mtt -91.7 174.39 7.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.514 -0.766 . . . . 63.21 110.877 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.66 166.55 23.38 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.99 -0.744 . . . . 71.21 108.99 163.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -73.8 -30.47 62.75 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.787 -0.571 . . . . 74.23 110.919 -178.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -72.26 -33.86 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.212 -0.449 . . . . 71.52 110.718 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.3 ttm -75.0 -27.5 60.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.724 -0.671 . . . . 71.55 110.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -75.7 -43.1 48.9 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.516 0.726 . . . . 62.35 111.923 -177.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -72.13 -29.02 63.65 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.658 -0.246 . . . . 73.14 110.994 174.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.96 -30.98 68.47 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 116.148 -0.478 . . . . 75.13 110.278 174.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.543 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -62.78 -43.32 99.11 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 123.004 0.522 . . . . 75.22 111.75 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -69.41 -33.9 73.67 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.365 0.416 . . . . 73.34 111.578 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -65.3 -42.94 92.54 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.347 -0.842 . . . . 60.32 110.727 176.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.806 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 90.6 m -74.24 -36.32 63.89 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.973 -1.012 . . . . 73.32 111.665 -178.275 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.893 HD22 ' HG2' ' A' ' 24' ' ' MET . 49.4 mt -69.43 -31.1 69.22 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.814 -0.553 . . . . 64.34 112.384 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.64 91.81 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.668 0.618 . . . . 65.43 112.668 -177.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.806 ' HE3' ' HA ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -88.93 -7.71 55.54 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.197 0.814 . . . . 64.14 113.197 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.453 HG22 ' HG3' ' A' ' 20' ' ' LYS . 49.8 mt -97.53 -20.83 5.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.964 0.412 . . . . 63.33 109.901 174.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -50.28 -43.69 79.09 Favored Pre-proline 0 CA--C 1.559 1.301 0 N-CA-C 115.64 1.718 . . . . 74.25 115.64 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -80.15 8.64 3.99 Favored 'Trans proline' 0 C--N 1.385 2.458 0 CA-C-N 122.289 1.853 . . . . 74.11 114.474 178.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 40.1 mt -100.48 145.73 27.92 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 110.172 -0.307 . . . . 73.11 110.172 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.5 t -98.15 29.01 3.7 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-O 121.502 0.667 . . . . 73.44 110.852 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.926 ' HG2' ' HB3' ' A' ' 20' ' ' LYS . 47.3 mt-10 83.35 -28.66 0.1 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 126.706 2.002 . . . . 72.35 112.85 172.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -72.4 -33.58 67.27 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.028 0.442 . . . . 74.41 110.931 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -76.97 -29.15 55.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.472 -0.785 . . . . 75.45 110.485 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -71.91 -29.64 64.54 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.402 -0.363 . . . . 65.02 110.848 173.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.47 80.68 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.973 0.416 . . . . 73.31 110.968 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.63 -32.2 65.72 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.921 -1.036 . . . . 54.24 111.117 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.4 mt -86.5 -82.24 0.21 Allowed 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.074 -0.343 . . . . 72.22 110.074 176.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.34 -131.06 2.14 Favored 'General case' 0 C--N 1.35 0.626 0 C-N-CA 125.224 1.41 . . . . 44.43 111.537 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.4 mp -92.66 88.19 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.495 -0.928 . . . . 61.02 108.495 178.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.515 ' HE1' HD12 ' A' ' 4' ' ' LEU . 19.0 p90 -110.04 -32.54 6.98 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.454 -0.794 . . . . 74.14 111.36 -178.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.685 ' H ' HG21 ' A' ' 9' ' ' THR . . . -133.81 64.96 1.59 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.63 0.729 . . . . 63.32 111.235 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -132.17 20.3 4.45 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.779 0.799 . . . . 73.41 110.259 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -95.69 12.99 27.9 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.567 -0.742 . . . . 74.05 111.294 -176.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -111.35 9.74 21.56 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.969 -0.559 . . . . 75.23 111.826 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.514 HG13 HG22 ' A' ' 6' ' ' ILE . 28.5 m -108.82 11.88 8.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 120.565 0.222 . . . . 73.44 111.188 177.087 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.1 mp -83.37 85.05 7.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.208 -0.451 . . . . 62.35 110.494 -175.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 54.42 50.77 15.46 Favored 'General case' 0 C--N 1.346 0.431 0 O-C-N 125.039 1.462 . . . . 73.12 111.078 -175.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -74.98 -41.52 59.39 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 114.72 -1.127 . . . . 71.52 109.41 -178.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 46.3 t60 -143.49 114.62 7.85 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.044 -1.095 . . . . 65.12 108.044 169.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -147.92 146.82 29.17 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.835 -0.621 . . . . 74.35 110.528 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -140.66 -60.62 0.51 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.514 -0.551 . . . . 71.13 109.514 174.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 57.2 t60 60.47 91.87 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 125.006 1.441 . . . . 72.42 110.966 -173.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 27.7 p80 . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 115.339 -0.846 . . . . 73.3 111.332 -179.74 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 120.918 0.39 . . . . 62.21 110.118 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.811 HD11 ' HB3' ' A' ' 48' ' ' LYS . 15.1 tt -86.35 150.85 3.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.48 -0.782 . . . . 52.35 109.98 178.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.95 98.15 7.51 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.465 1.126 . . . . 74.51 109.862 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.9 mt -106.23 152.67 23.2 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.605 -1.18 . . . . 65.21 109.508 174.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.1 p -81.47 163.63 22.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.347 -0.541 . . . . 71.23 109.775 173.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.517 HG23 ' HB1' ' A' ' 64' ' ' ALA . 31.0 mm -67.62 -29.17 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 116.006 -0.543 . . . . 70.23 111.135 -174.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -70.86 -37.43 73.1 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.966 -0.561 . . . . 73.45 110.974 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.4 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 50.0 mt-10 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.604 0.594 . . . . 71.15 112.604 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.743 ' HB ' ' HB3' ' A' ' 64' ' ' ALA . 3.4 m -74.88 -29.32 60.97 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.738 0.304 . . . . 74.34 110.647 178.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.446 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.5 t-20 -67.61 -38.89 84.61 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.096 -0.335 . . . . 74.55 110.096 171.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.754 HD21 ' HA ' ' A' ' 42' ' ' ALA . 19.1 tp -60.71 -38.54 85.41 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.984 0.913 . . . . 72.2 111.64 175.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 89.5 mt -66.77 -32.72 74.19 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.836 -0.62 . . . . 44.5 111.423 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 t -72.0 -29.04 63.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.243 0.617 . . . . 64.25 112.081 177.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.69 HD12 ' HA ' ' A' ' 11' ' ' LEU . 71.8 mt -66.44 -42.69 90.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.119 0.568 . . . . 75.4 110.051 178.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.422 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . 75.9 m-85 -111.03 35.28 3.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.809 -0.632 . . . . 74.53 110.91 -175.317 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -83.31 103.7 12.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.482 0.658 . . . . 64.01 111.815 -172.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -142.3 122.2 13.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.793 -1.094 . . . . 64.44 110.122 171.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.04 -96.65 2.0 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.66 -0.7 . . . . 73.23 111.762 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.25 -131.28 1.2 Allowed Glycine 0 C--O 1.216 -0.973 0 N-CA-C 110.667 -0.973 . . . . 55.01 110.667 178.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -64.46 -46.18 84.19 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.63 0.772 . . . . 62.03 111.034 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -71.03 -47.89 56.09 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 123.372 0.42 . . . . 74.15 111.047 -175.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.65 -29.58 75.45 Favored Glycine 0 C--N 1.336 0.53 0 O-C-N 123.868 0.73 . . . . 64.54 113.531 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -43.83 98.25 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.468 0.307 . . . . 73.52 111.097 171.287 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.839 ' HG2' HD22 ' A' ' 46' ' ' LEU . 49.2 mtt -68.72 -38.63 80.36 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.335 0.397 . . . . 45.24 111.004 177.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.06 -44.99 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.171 0.434 . . . . 73.43 112.171 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.422 ' HB3' ' HB3' ' A' ' 15' ' ' TYR . 0.2 OUTLIER -69.48 -43.47 73.12 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.584 0.553 . . . . 60.12 110.576 -179.648 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.48 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 30.9 mt -63.78 -48.19 87.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 119.12 -0.467 . . . . 71.24 111.972 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.7 -30.47 67.05 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.695 0.628 . . . . 73.21 112.695 -176.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.93 -33.72 66.12 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.033 0.208 . . . . 61.24 111.011 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.582 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -95.84 7.57 45.95 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.792 0.664 . . . . 51.24 112.792 -176.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 49.3 mt -60.93 -44.7 95.59 Favored Pre-proline 0 N--CA 1.481 1.119 0 N-CA-C 113.954 1.094 . . . . 64.33 113.954 178.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -65.35 -19.59 61.7 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.023 1.815 . . . . 72.12 114.312 174.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.582 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 20.2 m-85 -96.94 -10.49 26.25 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.713 0.292 . . . . 74.23 110.395 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.3 ttm -86.35 143.23 27.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 72.01 110.718 -171.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.42 145.56 51.29 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.851 0.719 . . . . 53.45 109.413 172.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -60.06 -30.58 69.3 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.887 1.069 . . . . 72.44 113.887 -173.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -70.06 -44.61 68.81 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.02 0.438 . . . . 64.31 110.704 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.1 ttm -74.5 -29.65 61.5 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.133 -0.939 . . . . 72.2 111.292 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.427 ' HG3' HD22 ' A' ' 31' ' ' LEU . 22.4 ttt180 -69.26 -44.89 70.99 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.736 0.814 . . . . 73.45 111.729 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.53 -33.2 70.91 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 116.305 -0.407 . . . . 73.35 111.176 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.2 tp -67.91 -40.09 83.46 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.862 -0.608 . . . . 72.44 110.431 175.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.754 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -60.92 -45.08 96.07 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.91 0.884 . . . . 60.12 113.125 -176.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -66.48 -30.16 70.44 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.469 0.481 . . . . 70.5 112.094 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 -76.6 -33.48 58.43 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 123.128 0.267 . . . . 73.13 111.532 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.3 m -71.37 -31.3 67.15 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.569 0.348 . . . . 61.52 110.505 174.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.839 HD22 ' HG2' ' A' ' 24' ' ' MET . 63.1 mt -68.61 -30.27 68.97 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 122.642 0.377 . . . . 74.44 111.379 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.12 61.35 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 123.21 0.319 . . . . 54.44 111.639 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.811 ' HB3' HD11 ' A' ' 2' ' ' ILE . 5.8 mttt -84.43 -37.16 21.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.701 0.401 . . . . 62.11 111.8 175.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.78 -9.31 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 112.7 0.63 . . . . 61.12 112.7 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.4 -48.96 96.42 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.911 -1.042 . . . . 65.42 113.54 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.63 -4.81 15.42 Favored 'Trans proline' 0 C--N 1.385 2.468 0 CA-C-N 121.646 1.623 . . . . 73.24 113.977 176.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.547 HD11 HD12 ' A' ' 2' ' ' ILE . 43.6 mt -89.26 145.95 25.06 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.654 -0.499 . . . . 73.14 109.654 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.485 HG23 ' H ' ' A' ' 56' ' ' GLU . 11.5 t -83.62 163.24 20.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.741 -0.663 . . . . 72.22 109.805 172.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -61.53 -39.65 91.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.019 0.928 . . . . 73.21 111.477 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.9 -35.49 76.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.834 -0.621 . . . . 74.05 112.323 -176.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' H ' HG23 ' A' ' 53' ' ' THR . 39.2 tt0 -75.87 -33.54 59.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 123.248 0.342 . . . . 72.43 111.033 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -69.89 -30.64 68.13 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.026 0.204 . . . . 71.41 111.034 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.43 -24.2 63.8 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.044 0.387 . . . . 74.5 112.044 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -76.0 -27.29 57.35 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.251 -0.431 . . . . 55.01 111.294 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.482 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.8 mt -81.53 -55.32 4.75 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.922 -0.581 . . . . 64.45 110.757 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.88 -110.3 0.55 Allowed 'General case' 0 C--N 1.348 0.503 0 O-C-N 125.114 1.509 . . . . 63.43 110.183 -168.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.427 HG23 HG22 ' A' ' 9' ' ' THR . 48.3 mm -121.47 105.43 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.111 -0.7 . . . . 63.41 109.111 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.482 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 2.7 m-85 -97.48 24.16 6.9 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.026 -0.534 . . . . 73.23 111.813 178.331 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.743 ' HB3' ' HB ' ' A' ' 9' ' ' THR . . . -148.96 -149.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.315 -0.402 . . . . 44.22 110.114 -177.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 72.34 12.84 5.66 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.348 1.459 . . . . 55.24 112.435 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.405 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 32.3 t70 -101.5 -32.15 10.54 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 121.123 0.487 . . . . 74.23 110.479 -179.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.405 ' HB2' HG21 ' A' ' 6' ' ' ILE . 35.4 mt-10 -81.99 -13.13 57.85 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.403 -0.362 . . . . 72.25 111.776 176.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.9 m -112.27 35.54 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 116.425 -0.352 . . . . 62.45 111.756 -177.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 66' ' ' ASP . 96.0 mt -66.72 -44.49 81.46 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.319 -0.4 . . . . 70.3 111.235 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -92.31 -63.96 1.17 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.775 -0.648 . . . . 70.35 110.931 -175.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 2.2 t60 61.2 35.55 18.34 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.96 1.304 . . . . 73.32 108.901 -167.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 58.2 m80 62.83 -161.02 0.3 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.46 1.104 . . . . 74.53 110.883 -172.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -93.31 11.5 27.93 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.155 0.798 . . . . 74.43 113.155 -172.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -155.65 154.11 31.07 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.692 -0.484 . . . . 72.45 109.692 176.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.5 m80 72.34 113.47 0.06 Allowed 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 125.345 1.458 . . . . 75.05 112.323 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 . . . . . 0 N--CA 1.476 0.831 0 C-N-CA 124.51 1.124 . . . . 75.04 110.916 178.389 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.591 ' HG3' HD22 ' A' ' 60' ' ' LEU . 12.3 tmm? . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 109.648 -0.501 . . . . 72.22 109.648 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.764 HD13 ' HB3' ' A' ' 48' ' ' LYS . 93.3 mt 75.61 -45.84 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 125.148 1.379 . . . . 65.13 114.185 172.037 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 85.11 80.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 127.426 2.29 . . . . 72.42 108.595 -171.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.493 HD22 ' HG2' ' A' ' 8' ' ' GLU . 76.6 mt -121.56 166.9 13.52 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 113.511 -1.677 . . . . 73.24 108.395 175.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 15.3 t -98.67 173.52 6.86 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 109.244 -0.65 . . . . 65.4 109.244 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.564 HG21 ' HB2' ' A' ' 67' ' ' GLU . 10.7 mm -60.32 -24.94 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.953 1.301 . . . . 72.24 112.192 -175.348 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.89 -37.79 70.09 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.724 0.809 . . . . 72.22 112.564 -178.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.522 ' HA ' HD11 ' A' ' 41' ' ' LEU . 1.3 mp0 -63.74 -43.96 94.94 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.174 0.512 . . . . 72.25 110.943 178.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.432 ' HA ' ' HG ' ' A' ' 12' ' ' LEU . 6.7 p -74.96 -25.36 58.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.659 -1.155 . . . . 54.14 112.666 178.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.469 ' O ' HG13 ' A' ' 14' ' ' ILE . 65.7 t30 -66.52 -33.51 75.83 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.916 0.486 . . . . 55.51 111.151 174.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.432 ' HA ' HD12 ' A' ' 14' ' ' ILE . 58.7 tp -62.91 -33.96 76.42 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 122.816 0.446 . . . . 71.34 110.891 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.847 HD22 HD21 ' A' ' 23' ' ' LEU . 13.8 mt -71.46 -38.61 71.27 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.517 -0.765 . . . . 64.55 110.433 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.436 ' HB3' HG21 ' A' ' 62' ' ' ILE . 78.6 p -72.04 -22.19 61.42 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.785 0.661 . . . . 73.25 112.785 179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 10' ' ' ASN . 99.3 mt -60.88 -47.42 93.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.78 0.324 . . . . 73.31 110.218 174.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -91.91 -78.09 0.41 Allowed 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.22 -0.445 . . . . 54.32 110.947 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.6 t30 52.96 71.34 0.49 Allowed 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.727 1.267 . . . . 71.34 110.094 -172.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -140.31 123.25 16.53 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.495 -1.229 . . . . 73.22 109.818 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.34 21.24 79.46 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 115.272 0.869 . . . . 75.11 115.272 168.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.71 -140.49 29.17 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 121.294 -0.479 . . . . 53.42 112.595 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.811 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -76.8 -33.68 57.98 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 123.745 0.32 . . . . 64.32 111.307 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.502 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 38.6 mtt180 -65.28 -61.42 2.13 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 119.427 -0.321 . . . . 71.41 110.96 177.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.28 -30.82 78.71 Favored Glycine 0 C--O 1.214 -1.111 0 O-C-N 124.56 1.163 . . . . 40.4 113.924 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.847 HD21 HD22 ' A' ' 12' ' ' LEU . 26.3 tp -65.18 -48.86 71.96 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 117.317 0.558 . . . . 63.13 110.632 177.25 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.0 mtp -69.95 -36.79 75.55 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 123.423 0.452 . . . . 72.14 111.435 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 62.4 mm-40 -68.74 -39.86 80.12 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.269 0.355 . . . . 74.51 111.779 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -69.59 -42.77 74.0 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 119.382 -0.342 . . . . 35.22 111.397 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.421 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 40.3 mt -62.88 -43.73 99.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 O-C-N 123.784 0.677 . . . . 75.24 112.051 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.25 -39.79 95.61 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.06 0.763 . . . . 74.33 113.06 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.71 29.67 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.83 0.678 . . . . 71.52 112.83 -177.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.652 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -114.47 19.39 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.14 0.793 . . . . 63.34 113.14 -171.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 39.3 mt -51.0 -52.58 56.81 Favored Pre-proline 0 CA--C 1.552 1.049 0 N-CA-C 114.117 1.154 . . . . 71.34 114.117 174.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.48 -15.1 41.3 Favored 'Trans proline' 0 C--N 1.382 2.327 0 C-N-CA 121.777 1.651 . . . . 72.23 114.101 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.652 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 55.6 m-85 -96.58 -1.27 47.32 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.278 0.231 . . . . 74.2 111.452 -175.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 66.6 mtt -78.19 -77.82 0.15 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.941 0.4 . . . . 63.15 111.548 178.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -162.88 -90.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.107 -0.951 . . . . 62.22 109.136 -167.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 176.18 -51.92 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.765 1.226 . . . . 74.24 108.218 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -73.69 -38.08 64.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.248 -0.887 . . . . 63.11 109.366 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.427 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -62.47 -25.69 68.13 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.628 -1.169 . . . . 73.04 113.237 178.096 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -62.56 -52.6 62.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.138 0.575 . . . . 75.04 111.202 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -68.88 -36.19 77.78 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.441 0.696 . . . . 73.22 111.551 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.522 HD11 ' HA ' ' A' ' 8' ' ' GLU . 61.4 tp -59.64 -38.08 80.42 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.581 1.153 . . . . 54.0 111.807 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.29 82.66 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 124.121 0.888 . . . . 70.1 113.273 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -60.34 -40.82 92.04 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.704 0.628 . . . . 64.22 111.856 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 44' ' ' ARG . 48.0 mtm105 -76.2 -35.18 59.19 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.631 0.604 . . . . 75.13 112.631 -178.597 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.439 HG21 HD21 ' A' ' 12' ' ' LEU . 1.7 m -79.11 -38.6 35.78 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.597 0.221 . . . . 74.21 111.597 -176.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -66.6 -31.09 71.57 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.273 0.472 . . . . 72.53 112.273 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.81 -23.71 64.3 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.638 0.586 . . . . 74.33 111.555 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.764 ' HB3' HD13 ' A' ' 2' ' ' ILE . 73.9 mmtt -88.56 -28.3 20.82 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.256 -0.429 . . . . 63.34 112.033 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.432 ' HA ' HD12 ' A' ' 52' ' ' LEU . 35.6 mt -93.01 -21.11 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 110.703 -0.11 . . . . 71.33 110.703 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.43 -47.58 95.75 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 114.687 1.365 . . . . 72.51 114.687 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.16 5.64 6.11 Favored 'Trans proline' 0 C--N 1.383 2.346 0 CA-C-N 121.902 1.715 . . . . 72.32 114.385 176.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 49' ' ' ILE . 96.1 mt -98.75 168.19 10.3 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.502 -0.555 . . . . 74.33 109.502 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.443 ' OG1' ' HG2' ' A' ' 56' ' ' GLU . 63.5 p -102.96 -179.81 4.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.753 -0.462 . . . . 74.41 109.753 173.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.811 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -75.11 -22.71 58.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.858 -0.61 . . . . 63.52 110.721 174.336 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -74.39 -35.77 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.442 -0.799 . . . . 75.15 110.489 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.443 ' HG2' ' OG1' ' A' ' 53' ' ' THR . 21.5 mm-40 -70.9 -39.22 72.88 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.242 -0.436 . . . . 63.13 110.876 176.025 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -70.05 -28.21 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.173 -0.467 . . . . 73.13 111.045 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.19 -28.55 68.19 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 111.836 0.31 . . . . 60.42 111.836 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.43 -30.23 64.42 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.459 0.303 . . . . 63.31 111.792 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.591 HD22 ' HG3' ' A' ' 1' ' ' MET . 17.6 mt -79.01 -54.39 6.07 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.749 -0.463 . . . . 75.14 109.749 -178.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 52.21 42.93 31.0 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 125.214 1.571 . . . . 74.14 112.975 174.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.46 HG13 ' HB2' ' A' ' 12' ' ' LEU . 3.2 mp 68.98 112.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.981 0.912 . . . . 64.05 109.368 -168.483 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.68 -31.43 19.74 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.339 -0.846 . . . . 64.13 111.298 -171.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.464 ' HB1' HG23 ' A' ' 6' ' ' ILE . . . -154.42 128.26 8.78 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.024 0.44 . . . . 61.14 111.459 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -155.59 170.17 22.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.844 -0.616 . . . . 73.41 110.231 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.43 ' HA ' ' HG ' ' A' ' 69' ' ' LEU . 0.9 OUTLIER 75.82 -26.33 0.19 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 125.155 1.382 . . . . 70.02 113.401 177.557 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.564 ' HB2' HG21 ' A' ' 6' ' ' ILE . 7.6 mm-40 -76.02 -14.11 60.22 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.897 0.879 . . . . 65.52 111.372 -178.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 m -123.27 15.08 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 116.232 -0.44 . . . . 54.14 111.954 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.43 ' HG ' ' HA ' ' A' ' 66' ' ' ASP . 30.2 mt -77.73 146.77 35.73 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.671 0.249 . . . . 73.22 111.671 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.415 ' HG2' ' HA ' ' A' ' 76' ' ' HIS . 16.8 mt-10 56.88 34.49 24.88 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.357 1.063 . . . . 72.23 112.472 176.232 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 2.3 m80 -87.99 -171.14 3.27 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 115.931 -0.577 . . . . 75.1 110.456 177.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -82.15 85.08 6.85 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.956 0.884 . . . . 74.33 113.004 -170.146 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -168.89 -58.81 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 113.141 -1.845 . . . . 74.31 106.236 170.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -135.62 154.66 51.25 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.099 -0.501 . . . . 74.24 110.551 177.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -89.52 146.58 24.51 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 107.944 -1.132 . . . . 74.35 107.944 173.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.415 ' HA ' ' HG2' ' A' ' 70' ' ' GLU . 91.6 m-70 . . . . . 0 N--CA 1.481 1.103 0 O-C-N 124.549 1.156 . . . . 61.03 111.706 -174.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ptp . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.766 0.317 . . . . 73.41 110.648 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.581 HG21 ' HG3' ' A' ' 48' ' ' LYS . 12.5 tt -72.75 142.51 15.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 115.653 -0.703 . . . . 74.35 109.547 171.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -74.98 110.42 9.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.653 -0.869 . . . . 73.32 108.653 176.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.57 HD11 ' HD2' ' A' ' 48' ' ' LYS . 90.4 mt -116.43 157.27 25.4 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.514 -0.767 . . . . 62.41 110.935 178.05 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.488 HG22 ' HG2' ' A' ' 8' ' ' GLU . 8.2 t -90.27 169.66 10.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 115.475 -0.784 . . . . 61.05 108.889 167.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.685 HG21 ' HB2' ' A' ' 67' ' ' GLU . 17.1 mm -63.38 -32.02 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.414 0.686 . . . . 74.41 112.203 -176.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -71.52 -24.28 61.93 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.57 0.581 . . . . 64.32 112.57 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.502 ' HB3' HG23 ' A' ' 45' ' ' THR . 32.5 mm-40 -63.82 -52.53 59.75 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.492 0.663 . . . . 74.12 110.307 176.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -26.4 61.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.648 -1.16 . . . . 75.41 112.25 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.499 ' HB2' HG21 ' A' ' 68' ' ' VAL . 12.4 t30 -66.92 -39.59 87.4 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.733 0.413 . . . . 75.2 111.152 172.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.631 HD21 ' HA ' ' A' ' 42' ' ' ALA . 27.6 tp -69.43 -37.12 77.27 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.296 0.638 . . . . 65.13 111.153 175.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.7 mt -66.11 -32.06 73.3 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.932 -0.576 . . . . 75.33 111.743 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.1 t -65.75 -32.58 74.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.798 0.687 . . . . 64.01 111.292 177.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 62.6 mt -67.08 -36.66 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 123.3 0.64 . . . . 53.24 110.854 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -116.59 28.5 8.52 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 65.32 112.303 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -83.44 95.76 8.35 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.41 -0.359 . . . . 74.3 110.948 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -166.4 136.06 3.17 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.932 -0.576 . . . . 52.53 110.007 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.38 23.68 60.34 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 115.316 0.886 . . . . 53.45 115.316 169.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 -144.5 31.33 Favored Glycine 0 C--O 1.222 -0.631 0 CA-C-N 117.216 0.508 . . . . 63.22 112.331 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -79.25 -36.92 39.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.523 0.329 . . . . 75.45 110.702 176.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -64.8 -47.84 76.61 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.321 -0.399 . . . . 75.31 110.903 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.68 -35.56 90.01 Favored Glycine 0 C--O 1.219 -0.822 0 CA-C-O 119.326 -0.708 . . . . 54.42 112.773 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.91 -47.19 83.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.939 0.495 . . . . 70.2 111.172 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.458 ' HG2' HD22 ' A' ' 46' ' ' LEU . 42.9 mtt -68.98 -35.59 76.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.792 -0.64 . . . . 71.12 112.133 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -72.57 -33.56 66.87 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.01 0.374 . . . . 74.34 112.01 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -71.03 -37.63 72.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.658 0.383 . . . . 71.41 111.383 176.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.29 -41.95 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 116.211 -0.45 . . . . 71.42 111.349 178.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -70.25 -28.97 65.66 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.92 0.711 . . . . 60.44 112.92 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.23 -28.49 62.19 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.597 0.237 . . . . 72.42 111.306 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.569 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.27 17.83 22.38 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.285 -0.416 . . . . 65.14 112.072 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.9 mt -68.33 -40.77 21.69 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-O 117.925 -1.036 . . . . 72.4 112.968 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.13 -3.0 12.46 Favored 'Trans proline' 0 C--N 1.382 2.305 0 CA-C-N 121.778 1.671 . . . . 74.13 113.885 168.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.569 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.0 m-85 -109.29 -164.01 0.91 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.201 0.6 . . . . 71.12 110.021 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.4 mtm 65.9 -169.9 0.2 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 125.035 1.334 . . . . 51.54 111.776 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -76.05 163.29 27.28 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.775 -0.648 . . . . 73.32 109.683 167.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -73.82 -24.73 59.83 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.726 -0.472 . . . . 73.02 109.726 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -66.09 -44.35 84.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.749 -0.659 . . . . 73.51 110.537 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' MET . . . . . 0.47 ' HG3' HD13 ' A' ' 11' ' ' LEU . 3.2 tpt -75.99 -25.81 56.14 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.421 -0.809 . . . . 63.35 111.205 -178.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -70.86 -44.65 65.94 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.501 1.12 . . . . 74.34 111.4 177.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -68.65 -33.38 73.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.13 -0.487 . . . . 74.21 111.566 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -66.21 -37.72 86.26 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.601 -0.727 . . . . 64.24 110.643 175.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.631 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -60.68 -37.66 82.36 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 113.571 0.952 . . . . 52.4 113.571 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -78.71 -27.44 44.94 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.133 0.271 . . . . 63.23 111.662 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -36.09 74.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.586 0.354 . . . . 75.45 111.153 172.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.502 HG23 ' HB3' ' A' ' 8' ' ' GLU . 1.6 m -81.24 -25.19 36.84 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.902 0.382 . . . . 71.21 111.583 178.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.458 HD22 ' HG2' ' A' ' 24' ' ' MET . 29.5 mt -66.58 -27.35 67.65 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.982 -0.449 . . . . 73.32 111.608 168.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.75 -18.17 64.17 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.332 0.493 . . . . 75.04 112.332 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.581 ' HG3' HG21 ' A' ' 2' ' ' ILE . 65.3 tttt -70.23 -56.48 6.69 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 110.07 -0.344 . . . . 75.22 110.07 170.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.8 mt -85.39 -20.23 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 112.833 0.679 . . . . 73.11 112.833 -163.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.87 95.88 Favored Pre-proline 0 CA--C 1.557 1.228 0 N-CA-C 114.202 1.186 . . . . 72.43 114.202 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.47 -4.28 14.04 Favored 'Trans proline' 0 C--N 1.377 2.075 0 CA-C-N 121.565 1.595 . . . . 64.05 114.161 172.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 48' ' ' LYS . 78.6 mt -85.38 133.57 34.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.433 -0.58 . . . . 74.44 109.433 176.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -89.19 24.43 2.16 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.763 0.653 . . . . 73.32 112.763 -172.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 76.64 -48.55 0.55 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 126.21 1.804 . . . . 64.02 112.732 173.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -64.48 -37.01 86.06 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.69 0.757 . . . . 70.15 109.657 170.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -68.67 -35.03 76.7 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.382 -1.281 . . . . 65.5 111.32 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -72.47 -24.9 61.25 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.919 0.487 . . . . 74.24 111.313 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -22.57 61.73 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.88 0.696 . . . . 63.34 112.88 -177.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.03 -29.48 49.42 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.837 0.351 . . . . 74.34 111.009 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.9 mt -88.89 -66.99 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.656 -0.702 . . . . 74.43 110.829 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 48.68 -105.76 0.16 Allowed 'General case' 0 CA--C 1.536 0.442 0 O-C-N 125.439 1.712 . . . . 72.44 112.304 -174.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 22.1 mm -115.41 104.31 16.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.595 -0.891 . . . . 75.01 108.595 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -110.41 -3.27 16.19 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.026 -0.534 . . . . 74.01 112.033 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -150.08 79.67 1.36 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.213 0.53 . . . . 52.32 111.63 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.452 ' O ' ' HG ' ' A' ' 69' ' ' LEU . . . -131.74 12.93 4.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.238 0.542 . . . . 65.03 110.389 173.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -76.34 -34.7 58.98 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.274 -0.876 . . . . 71.51 110.956 -176.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.685 ' HB2' HG21 ' A' ' 6' ' ' ILE . 8.6 mm-40 -75.88 -31.37 59.2 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.216 -0.902 . . . . 73.21 111.754 -175.349 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.499 HG21 ' HB2' ' A' ' 10' ' ' ASN . 3.9 m -85.07 -2.16 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 112.923 0.712 . . . . 62.3 112.923 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 65' ' ' ALA . 95.1 mt -72.14 -47.28 52.16 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.966 0.412 . . . . 72.51 110.63 174.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -101.36 76.09 1.67 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.656 0.741 . . . . 74.21 111.225 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 68' ' ' VAL . 26.9 m170 -127.61 86.82 2.53 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 114.529 -1.214 . . . . 73.22 108.094 169.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.5 m170 69.87 168.54 0.3 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 125.147 1.379 . . . . 61.45 111.199 -169.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -127.77 25.31 6.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.343 0.592 . . . . 75.45 110.377 -178.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -84.91 95.0 8.9 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.176 -0.676 . . . . 74.42 109.176 175.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 61.6 105.49 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.154 1.382 . . . . 71.42 111.88 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 14.6 t60 . . . . . 0 N--CA 1.483 1.201 0 O-C-N 124.237 0.961 . . . . 74.31 110.547 -179.597 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 98.4 mt . . . . . 0 C--O 1.236 0.365 0 CA-C-O 120.497 0.189 . . . . 70.439999999999998 110.749 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.4 p -82.41 175.15 10.46 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.22 -0.445 . . . . 73.150000000000006 111.043 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.46 -38.37 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.303 -0.408 . . . . 73.120000000000005 110.34 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.72 -44.61 95.78 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 122.903 0.481 . . . . 75.310000000000002 110.989 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.439 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 46.3 mt-10 -65.79 -51.49 58.65 Favored 'General case' 0 CA--C 1.526 0.035 0 O-C-N 124.194 0.934 . . . . 71.340000000000003 112.413 -176.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.432 HG21 ' H ' ' A' ' 64' ' ' ALA . 3.0 m -74.18 -28.51 61.32 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 123.346 0.404 . . . . 61.039999999999999 111.759 -173.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -70.89 -32.92 70.04 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.385 -0.197 . . . . 72.340000000000003 111.437 176.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.468 HD12 HD12 ' A' ' 14' ' ' ILE . 54.8 tp -70.89 -35.52 72.36 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.621 0.248 . . . . 73.129999999999995 110.859 175.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.831 HD22 HD21 ' A' ' 23' ' ' LEU . 85.4 mt -67.07 -31.81 72.56 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 116.112 -0.495 . . . . 74.230000000000004 110.844 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -65.53 -25.3 67.39 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.841 0.857 . . . . 72.129999999999995 111.822 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.468 HD12 HD12 ' A' ' 11' ' ' LEU . 68.7 mt -72.54 -31.36 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 C-N-CA 123.213 0.605 . . . . 63.140000000000001 111.074 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.407 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . 94.7 m-85 -123.26 8.22 9.12 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 113.441 0.904 . . . . 72.530000000000001 113.441 -173.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.28 106.38 1.09 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.335 0.654 . . . . 72.439999999999998 112.316 -178.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -166.18 125.2 1.57 Allowed 'General case' 0 C--O 1.222 -0.384 0 O-C-N 124.127 0.892 . . . . 73.319999999999993 109.606 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.73 38.02 24.98 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.355 -0.45 . . . . 72.420000000000002 113.129 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.33 -147.66 36.25 Favored Glycine 0 C--N 1.334 0.468 0 N-CA-C 111.688 -0.565 . . . . 61.140000000000001 111.688 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.475 ' HG3' ' OE2' ' A' ' 54' ' ' GLU . 2.9 pptp? -93.28 -18.76 22.08 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.429 0.157 . . . . 75.329999999999998 110.63 177.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.474 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 18.5 mtp85 -65.93 -57.06 8.72 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.032 -0.531 . . . . 74.510000000000005 110.802 174.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.6 -29.0 74.17 Favored Glycine 0 C--O 1.209 -1.436 0 O-C-N 124.028 0.83 . . . . 62.130000000000003 112.659 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.831 HD21 HD22 ' A' ' 12' ' ' LEU . 26.3 tp -62.38 -44.57 96.14 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.191 0.596 . . . . 53.520000000000003 111.47 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.498 ' HG2' HD22 ' A' ' 46' ' ' LEU . 62.9 mtt -69.46 -36.7 76.84 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 122.514 0.326 . . . . 61.439999999999998 111.383 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 39.8 mm-40 -73.25 -30.91 63.79 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 123.29 0.369 . . . . 54.240000000000002 111.003 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.407 ' HB3' ' HB3' ' A' ' 15' ' ' TYR . 2.0 m-80 -68.62 -47.77 65.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.154 0.582 . . . . 52.049999999999997 111.182 174.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.576 HD12 HD21 ' A' ' 46' ' ' LEU . 44.7 mt -66.05 -48.11 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 O-C-N 123.647 0.592 . . . . 71.409999999999997 111.319 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.565 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 20.2 m-80 -70.61 -26.17 63.37 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.234 0.827 . . . . 75.430000000000007 113.234 -175.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.37 -28.09 41.92 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.688 0.28 . . . . 54.340000000000003 111.38 175.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.713 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -105.23 18.22 22.68 Favored 'General case' 0 C--O 1.221 -0.427 0 N-CA-C 112.18 0.437 . . . . 74.340000000000003 112.18 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.801 HD22 ' HG3' ' A' ' 39' ' ' ARG . 86.6 mt -60.19 -47.51 96.58 Favored Pre-proline 0 CA--C 1.554 1.119 0 N-CA-C 113.478 0.918 . . . . 63.219999999999999 113.478 176.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.07 -14.48 35.15 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.824 1.683 . . . . 62.210000000000001 113.747 175.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.713 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 70.3 m-85 -94.98 -8.43 36.94 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.843 0.354 . . . . 73.420000000000002 110.421 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.549 ' HE3' HD23 ' A' ' 31' ' ' LEU . 6.5 ttm -93.82 164.05 13.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.863 -0.608 . . . . 75.030000000000001 110.333 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.39 153.69 41.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.491 -0.777 . . . . 74.400000000000006 109.545 174.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.26 -41.6 97.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.983 0.364 . . . . 74.140000000000001 111.983 -179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.71 -34.78 72.3 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.867 0.365 . . . . 61.539999999999999 110.596 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.5 mtt -66.02 -36.52 83.49 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 115.65 -0.705 . . . . 73.239999999999995 112.328 174.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.801 ' HG3' HD22 ' A' ' 31' ' ' LEU . 48.8 ttp180 -74.49 -39.81 62.23 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.766 0.427 . . . . 72.340000000000003 111.661 -177.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -72.36 -29.04 63.42 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.831 0.348 . . . . 73.120000000000005 111.425 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.0 tp -72.09 -35.01 69.1 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.176 -0.466 . . . . 72.200000000000003 110.527 172.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.74 96.43 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 112.875 0.694 . . . . 62.149999999999999 112.875 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -70.18 -26.62 63.98 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.242 0.339 . . . . 73.299999999999997 111.849 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 -74.57 -42.37 58.88 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.437 0.295 . . . . 75.329999999999998 111.657 175.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.421 HG23 ' HB3' ' A' ' 8' ' ' GLU . 5.2 m -78.79 -33.6 46.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 73.049999999999997 112.213 -175.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.576 HD21 HD12 ' A' ' 27' ' ' ILE . 59.4 mt -69.85 -28.06 65.36 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 122.24 -0.288 . . . . 72.040000000000006 111.498 176.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.73 -17.62 62.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 122.564 0.346 . . . . 73.109999999999999 111.791 174.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -77.86 -32.26 51.9 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 122.471 0.308 . . . . 75.120000000000005 110.601 174.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.469 HG23 HD12 ' A' ' 52' ' ' LEU . 1.8 mt -98.94 -7.12 9.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.036 -0.529 . . . . 74.0 110.68 -175.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.29 -46.68 99.77 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-O 118.094 -0.955 . . . . 43.539999999999999 113.327 171.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.51 8.0 4.18 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.788 1.674 . . . . 72.409999999999997 114.294 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.469 HD12 HG23 ' A' ' 49' ' ' ILE . 78.1 mt -108.72 168.73 9.13 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.752 0.31 . . . . 72.209999999999994 110.81 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -110.37 -168.92 1.37 Allowed 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.159 -0.473 . . . . 73.109999999999999 110.602 174.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.475 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 2.9 mp0 -68.03 -29.0 67.88 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.927 0.491 . . . . 65.129999999999995 110.549 171.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.17 -45.99 71.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.435 0.694 . . . . 63.420000000000002 111.125 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -72.29 -33.58 67.52 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.347 0.499 . . . . 75.530000000000001 112.347 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.498 ' HD1' HD12 ' A' ' 60' ' ' LEU . 53.3 t80 -75.85 -25.08 55.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.094 0.247 . . . . 74.209999999999994 110.941 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.08 60.14 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.362 -0.211 . . . . 70.25 111.561 175.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.77 -32.96 58.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.423 0.289 . . . . 53.32 110.832 172.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.498 HD12 ' HD1' ' A' ' 57' ' ' TYR . 47.3 mt -70.8 -59.83 2.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.188 -0.671 . . . . 61.119999999999997 109.188 173.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.58 28.6 12.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.733 1.613 . . . . 73.099999999999994 113.832 171.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 33.1 mm 62.04 89.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.493 0 C-N-CA 124.562 1.145 . . . . 70.450000000000003 110.77 -171.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -97.03 -39.35 9.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.713 -1.131 . . . . 72.430000000000007 110.532 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.432 ' H ' HG21 ' A' ' 9' ' ' THR . . . -105.9 76.44 1.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.255 0.55 . . . . 42.240000000000002 112.364 -173.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.376 0 CA-C-N 115.166 -0.925 . . . . 50.229999999999997 110.13 172.128 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.8 mt . . . . . 0 C--O 1.238 0.478 0 N-CA-C 109.513 -0.551 . . . . 62.109999999999999 109.513 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -82.57 174.63 10.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.379 -0.373 . . . . 73.430000000000007 111.093 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.1 mm -62.68 -34.47 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 123.932 0.77 . . . . 73.540000000000006 111.181 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -74.18 -33.43 63.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 122.749 0.419 . . . . 65.109999999999999 111.884 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 49.6 mt-10 -73.78 -37.99 64.81 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.471 -0.331 . . . . 64.109999999999999 111.181 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.7 p -74.29 -27.21 60.63 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.049 -0.523 . . . . 61.340000000000003 112.088 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.467 ' O ' HG12 ' A' ' 14' ' ' ILE . 23.9 t-20 -67.77 -37.56 82.25 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.935 0.494 . . . . 74.209999999999994 110.914 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.458 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 17.7 tp -63.4 -37.9 89.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.449 0.7 . . . . 65.120000000000005 111.228 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 57.4 mt -68.28 -35.99 78.69 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.404 -0.816 . . . . 63.130000000000003 110.595 174.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -70.22 -24.22 63.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.975 0.91 . . . . 55.340000000000003 112.303 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 10' ' ' ASN . 40.6 mm -61.14 -45.26 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.023 0.529 . . . . 73.349999999999994 110.049 175.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -104.64 -76.0 0.61 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.72 -0.673 . . . . 75.530000000000001 111.171 -172.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 65.1 t30 53.4 76.16 0.22 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.257 1.423 . . . . 54.240000000000002 112.284 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -153.51 128.74 9.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.208 -0.906 . . . . 54.549999999999997 110.216 -177.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.92 37.68 92.35 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 124.057 0.848 . . . . 64.329999999999998 114.44 172.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.54 -143.94 37.91 Favored Glycine 0 C--N 1.335 0.527 0 N-CA-C 111.947 -0.461 . . . . 73.129999999999995 111.947 -176.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.512 ' HB2' HD12 ' A' ' 49' ' ' ILE . 1.2 pptp? -92.77 -14.84 27.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.554 -0.535 . . . . 61.32 109.554 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -67.92 -52.64 33.92 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.051 -0.977 . . . . 65.030000000000001 110.081 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.77 -27.92 73.49 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.269 -0.878 . . . . 50.43 112.75 174.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.492 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -60.02 -42.77 95.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.845 0.323 . . . . 63.140000000000001 110.937 172.189 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.868 ' HG2' HD22 ' A' ' 46' ' ' LEU . 51.9 mtt -68.92 -37.55 79.0 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.252 0.345 . . . . 64.540000000000006 111.711 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -67.05 -39.88 87.01 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.559 0.537 . . . . 74.200000000000003 111.742 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -76.33 -32.88 58.94 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 112.306 0.484 . . . . 75.299999999999997 112.306 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 31.7 mt -71.36 -44.99 71.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-O 119.271 -0.395 . . . . 73.510000000000005 111.29 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.478 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 m-80 -67.65 -33.84 75.75 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.262 0.467 . . . . 75.400000000000006 112.262 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.8 -31.64 64.99 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.256 0.348 . . . . 74.219999999999999 111.523 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.752 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.35 20.26 19.17 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 112.907 0.706 . . . . 72.120000000000005 112.907 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.478 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 80.0 mt -55.9 -47.68 98.25 Favored Pre-proline 0 CA--C 1.555 1.139 0 N-CA-C 113.286 0.847 . . . . 71.540000000000006 113.286 175.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.55 3.6 7.6 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.164 1.451 . . . . 72.129999999999995 114.245 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.752 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.7 m-85 -103.41 -29.6 11.1 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.705 0.288 . . . . 73.030000000000001 110.765 -178.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.3 ptp -81.9 170.63 15.41 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.885 -0.783 . . . . 60.109999999999999 108.885 169.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.09 155.11 40.26 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.205 0.316 . . . . 64.519999999999996 110.451 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -68.03 -32.75 73.34 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 111.99 0.367 . . . . 73.030000000000001 111.99 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.79 -36.09 72.87 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.184 0.516 . . . . 65.439999999999998 111.091 175.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 6.5 tpt -72.52 -26.96 61.96 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.956 -1.02 . . . . 72.030000000000001 110.881 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -73.38 -39.33 65.2 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.237 1.015 . . . . 73.430000000000007 111.371 178.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.18 -35.29 79.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.475 -0.33 . . . . 62.310000000000002 111.188 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.61 -40.17 76.76 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.646 -0.706 . . . . 65.439999999999998 110.82 173.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.571 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -58.86 -45.24 90.58 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 124.078 0.951 . . . . 62.100000000000001 113.47 -175.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -67.37 -28.97 68.39 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.569 0.543 . . . . 74.319999999999993 111.828 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.476 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 78.5 mtp180 -78.95 -33.77 44.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.355 -0.384 . . . . 70.109999999999999 111.544 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.426 ' O ' HG12 ' A' ' 49' ' ' ILE . 17.7 m -73.82 -27.24 61.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 122.781 0.433 . . . . 75.209999999999994 110.46 175.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.868 HD22 ' HG2' ' A' ' 24' ' ' MET . 38.8 mt -68.72 -30.81 69.53 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 111.406 0.15 . . . . 75.450000000000003 111.406 172.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.15 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 120.852 0.358 . . . . 72.430000000000007 111.407 173.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 74.3 mmtt -78.33 -48.51 15.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 115.938 -0.573 . . . . 75.310000000000002 110.261 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.512 HD12 ' HB2' ' A' ' 20' ' ' LYS . 16.0 pt -81.97 -13.3 12.4 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 N-CA-C 113.21 0.818 . . . . 53.229999999999997 113.21 -176.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -43.06 -48.36 14.85 Favored Pre-proline 0 N--CA 1.486 1.36 0 N-CA-C 116.338 1.977 . . . . 71.530000000000001 116.338 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -82.59 27.62 0.6 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 CA-C-N 122.301 1.857 . . . . 73.219999999999999 115.386 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.9 mt -102.11 143.55 31.8 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.78 0.8 . . . . 74.209999999999994 111.887 177.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.615 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 22.7 m -101.62 26.31 7.49 Favored 'General case' 0 CA--C 1.56 1.363 0 CA-C-N 114.023 -1.444 . . . . 70.230000000000004 110.854 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 77.86 -51.26 0.51 Allowed 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 125.995 1.718 . . . . 74.010000000000005 112.652 173.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -70.11 -31.27 68.75 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.701 0.8 . . . . 53.240000000000002 110.986 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.615 ' OE1' ' HB ' ' A' ' 53' ' ' THR . 26.4 mp0 -67.53 -35.52 79.25 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.898 -0.592 . . . . 72.230000000000004 111.011 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -75.04 -27.25 59.97 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-N 115.807 -0.633 . . . . 75.400000000000006 110.335 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.07 -22.73 60.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 117.877 0.308 . . . . 73.109999999999999 111.461 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -79.17 -31.21 43.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.957 0.503 . . . . 73.530000000000001 111.634 175.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.7 mt -89.14 -51.66 5.47 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.565 -0.289 . . . . 63.149999999999999 110.586 -178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.68 -121.71 1.83 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.226 1.81 . . . . 73.439999999999998 111.878 178.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 24.3 mm -95.88 100.48 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.401 -1.333 . . . . 65.219999999999999 107.401 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -92.06 -26.32 18.37 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.677 -0.692 . . . . 75.510000000000005 112.112 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -139.77 88.07 2.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.536 0.684 . . . . 42.200000000000003 111.872 -179.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.485 0 CA-C-O 121.51 0.671 . . . . 74.239999999999995 110.51 175.107 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.448 HD22 HG23 ' A' ' 45' ' ' THR . 74.8 mt . . . . . 0 CA--C 1.514 -0.424 0 CA-C-O 120.927 0.394 . . . . 63.409999999999997 110.142 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.2 166.97 20.9 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.227 -0.897 . . . . 73.439999999999998 109.848 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.5 mm -67.94 -24.13 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.17 0.588 . . . . 65.299999999999997 111.982 -174.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.23 -34.42 65.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.862 -0.608 . . . . 62.009999999999998 110.676 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 40.6 mt-10 -73.51 -37.14 65.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.454 0.471 . . . . 71.239999999999995 111.357 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -73.21 -27.66 61.74 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.496 0.498 . . . . 71.430000000000007 111.687 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.445 ' O ' HG12 ' A' ' 14' ' ' ILE . 9.0 t-20 -64.48 -40.07 94.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.003 0.521 . . . . 61.049999999999997 111.046 171.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.582 HD21 ' HA ' ' A' ' 42' ' ' ALA . 16.7 tp -60.7 -34.34 74.22 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.067 0.947 . . . . 73.319999999999993 111.561 175.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.722 HD22 HD21 ' A' ' 23' ' ' LEU . 40.0 mt -71.07 -35.81 72.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.627 -0.715 . . . . 71.239999999999995 110.572 178.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.594 ' HA ' HD12 ' A' ' 62' ' ' ILE . 17.1 t -71.23 -23.75 62.06 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.32 -0.854 . . . . 74.109999999999999 112.902 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 10' ' ' ASN . 27.8 mm -61.87 -45.78 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.883 0.473 . . . . 72.420000000000002 110.142 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -106.33 -84.16 0.51 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.612 -0.709 . . . . 73.120000000000005 111.265 -174.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.473 ' H ' HD13 ' A' ' 23' ' ' LEU . 65.0 t30 46.58 87.02 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.238 1.415 . . . . 74.430000000000007 112.894 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -93.17 -83.98 0.3 Allowed 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.027 -0.421 . . . . 73.319999999999993 110.575 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -120.13 83.81 0.36 Allowed Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 109.987 -1.245 . . . . 73.430000000000007 109.987 177.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.07 -134.94 20.67 Favored Glycine 0 N--CA 1.449 -0.46 0 O-C-N 124.395 0.703 . . . . 44.310000000000002 111.422 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 3.0 pptp? -97.91 -22.03 16.56 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 123.8 0.353 . . . . 74.299999999999997 111.157 178.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HB2' ' OE1' ' A' ' 54' ' ' GLU . 53.3 ttp180 -70.23 -51.04 33.77 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.568 0.543 . . . . 72.150000000000006 110.33 -178.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.33 -29.18 71.95 Favored Glycine 0 C--O 1.223 -0.571 0 O-C-N 124.183 0.927 . . . . 42.32 112.592 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.722 HD21 HD22 ' A' ' 12' ' ' LEU . 26.8 tp -63.14 -41.86 99.38 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.264 0.625 . . . . 71.430000000000007 110.97 172.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.779 ' HG2' HD22 ' A' ' 46' ' ' LEU . 58.0 mtt -67.42 -37.91 83.77 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 122.979 0.512 . . . . 64.319999999999993 111.64 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 49.0 mm-40 -67.09 -37.8 84.58 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 123.411 0.445 . . . . 74.420000000000002 110.978 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -71.27 -33.89 70.19 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 112.388 0.514 . . . . 65.409999999999997 112.388 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.9 mt -71.56 -46.56 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 123.183 0.302 . . . . 43.229999999999997 111.049 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.409 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 22.2 m-80 -71.95 -31.23 66.11 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.053 0.761 . . . . 65.25 113.053 -176.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.87 -30.37 50.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.541 0.2 . . . . 72.430000000000007 111.541 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.753 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.68 18.42 19.35 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.448 0.536 . . . . 35.399999999999999 112.448 -178.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 71.9 mt -57.81 -46.34 99.74 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 113.521 0.934 . . . . 63.219999999999999 113.521 171.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -67.96 -18.26 46.47 Favored 'Trans proline' 0 C--N 1.383 2.353 0 CA-C-N 121.666 1.631 . . . . 73.400000000000006 113.399 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.753 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 90.7 m-85 -90.44 -32.78 16.25 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 122.376 0.27 . . . . 74.209999999999994 111.574 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptp -81.6 168.9 17.69 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.608 0.242 . . . . 61.009999999999998 110.761 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.55 171.81 14.57 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.961 -0.563 . . . . 64.25 112.029 -177.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -36.85 85.44 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.57 -0.741 . . . . 64.519999999999996 112.936 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.22 -35.84 66.37 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.394 0.434 . . . . 73.140000000000001 110.753 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 50.6 ttm -73.99 -30.48 62.5 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.45 0.469 . . . . 74.329999999999998 111.065 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.4 mtm-85 -68.8 -41.56 78.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.766 0.284 . . . . 74.230000000000004 111.766 174.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.09 -47.68 85.2 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 123.838 0.711 . . . . 65.340000000000003 111.065 175.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.5 tp -61.49 -41.93 98.02 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 124.568 1.168 . . . . 65.299999999999997 111.58 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.582 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -55.73 -43.91 77.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.514 1.134 . . . . 74.409999999999997 113.468 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -64.12 -36.16 83.13 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.888 0.742 . . . . 61.420000000000002 112.441 -176.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -80.12 -34.86 37.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.406 -0.361 . . . . 64.140000000000001 111.964 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.448 HG23 HD22 ' A' ' 4' ' ' LEU . 13.7 m -72.28 -39.93 67.98 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.645 0.378 . . . . 65.430000000000007 111.618 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.779 HD22 ' HG2' ' A' ' 24' ' ' MET . 63.9 mt -65.93 -29.0 69.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.194 0.442 . . . . 74.420000000000002 112.194 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.13 -23.02 63.92 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 123.508 0.505 . . . . 41.030000000000001 112.189 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -87.49 -27.82 22.42 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 122.43 0.292 . . . . 71.230000000000004 111.665 -178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.56 HG23 HD12 ' A' ' 52' ' ' LEU . 9.9 mt -98.11 -12.39 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 121.144 0.497 . . . . 73.120000000000005 110.691 -176.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.01 99.31 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 114.456 1.28 . . . . 60.509999999999998 114.456 173.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.99 -12.56 26.04 Favored 'Trans proline' 0 C--N 1.385 2.486 0 CA-C-N 121.863 1.701 . . . . 74.340000000000003 114.414 174.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.56 HD12 HG23 ' A' ' 49' ' ' ILE . 72.6 mt -83.46 139.32 33.01 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.625 -0.509 . . . . 75.109999999999999 109.625 -176.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 56' ' ' GLU . 11.4 t -82.8 168.41 17.18 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 120.857 -0.337 . . . . 75.230000000000004 110.252 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 4.9 tp10 -64.13 -40.34 95.96 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.931 0.892 . . . . 74.409999999999997 111.404 -174.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -74.59 -29.73 61.43 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.862 -0.608 . . . . 70.430000000000007 111.597 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 53' ' ' THR . 51.5 tt0 -72.11 -36.25 69.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.224 -0.443 . . . . 72.430000000000007 111.324 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -74.33 -23.16 59.01 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.318 -0.401 . . . . 70.310000000000002 110.744 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.71 -24.71 67.05 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.964 0.357 . . . . 72.25 111.964 174.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -76.17 -25.86 55.64 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.93 0.492 . . . . 75.319999999999993 111.588 175.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 29.6 mt -93.29 -53.56 4.05 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.258 -0.428 . . . . 74.430000000000007 110.42 -175.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 63.92 -85.03 0.02 OUTLIER 'General case' 0 C--N 1.351 0.645 0 C-N-CA 126.477 1.911 . . . . 70.129999999999995 112.603 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.594 HD12 ' HA ' ' A' ' 13' ' ' SER . 49.5 mm -120.12 -44.79 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 108.838 -0.801 . . . . 74.409999999999997 108.838 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 72.12 -79.83 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.117 1.767 . . . . 74.510000000000005 112.669 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.08 69.22 1.48 Allowed 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 121.202 0.525 . . . . 72.239999999999995 112.147 -172.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.535 0 CA-C-O 121.304 0.574 . . . . 62.399999999999999 111.237 176.245 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.3 mt . . . . . 0 C--O 1.239 0.509 0 N-CA-C 109.22 -0.659 . . . . 75.040000000000006 109.22 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 14.8 t -72.82 156.09 39.26 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.905 -0.776 . . . . 70.040000000000006 108.905 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 48.0 mt -62.39 -27.26 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 123.853 0.861 . . . . 64.540000000000006 111.505 -173.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -73.12 -35.07 66.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.909 0.483 . . . . 63.049999999999997 111.877 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -73.18 -35.42 66.39 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.262 0.225 . . . . 34.409999999999997 110.977 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.611 HG21 ' H ' ' A' ' 64' ' ' ALA . 5.7 m -73.5 -28.95 62.18 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.852 0.72 . . . . 64.319999999999993 110.596 178.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 55.0 t30 -66.15 -39.69 90.0 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.904 -0.589 . . . . 71.409999999999997 110.879 170.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.465 HD13 ' HG3' ' A' ' 38' ' ' MET . 62.8 tp -67.05 -34.3 77.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.838 0.455 . . . . 70.239999999999995 111.064 177.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.635 HD13 ' HE1' ' A' ' 57' ' ' TYR . 72.4 mt -67.97 -32.86 73.57 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.585 -0.734 . . . . 73.340000000000003 111.088 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -72.01 -37.28 69.82 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.485 0.714 . . . . 74.510000000000005 112.484 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 90.3 mt -69.07 -45.48 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-O 120.968 0.414 . . . . 63.399999999999999 110.808 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -102.02 28.08 6.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.125 -0.489 . . . . 72.439999999999998 111.545 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.428 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 12.9 t-20 -73.27 100.3 3.1 Favored 'General case' 0 C--N 1.344 0.339 0 O-C-N 123.606 0.567 . . . . 75.219999999999999 110.247 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -113.84 -69.25 0.87 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.344 -0.844 . . . . 71.329999999999998 111.479 -174.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -146.56 64.0 0.44 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.893 -0.67 . . . . 34.130000000000003 111.869 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.19 -157.41 40.85 Favored Glycine 0 C--O 1.225 -0.42 0 C-N-CA 121.443 -0.408 . . . . 51.32 112.1 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -69.53 -33.9 73.47 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 122.595 0.358 . . . . 72.219999999999999 111.495 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.497 ' HA ' ' HD3' ' A' ' 21' ' ' ARG . 12.3 mmt180 -73.45 -43.46 60.25 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-O 118.803 -0.618 . . . . 65.219999999999999 112.133 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.82 -27.72 71.58 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 120.982 -0.628 . . . . 54.130000000000003 112.905 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.596 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.3 mm? -67.56 -54.49 19.47 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 122.843 0.457 . . . . 72.219999999999999 111.27 170.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.765 ' HG2' HD22 ' A' ' 46' ' ' LEU . 30.8 mtt -64.45 -44.46 91.02 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.014 0.746 . . . . 73.310000000000002 113.014 -174.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 18.1 mm-40 -68.9 -36.6 78.22 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 122.71 0.404 . . . . 63.32 111.795 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -70.91 -46.28 62.8 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.955 -0.387 . . . . 75.430000000000007 109.955 177.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.424 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 34.5 mt -62.29 -41.96 93.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.32 0.648 . . . . 74.549999999999997 112.338 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.14 -42.82 95.69 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.308 0.643 . . . . 71.219999999999999 112.183 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -27.34 36.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 72.349999999999994 112.073 -177.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.751 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -97.48 11.39 36.95 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 113.173 0.805 . . . . 74.310000000000002 113.173 -174.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 55.4 mt -57.9 -45.88 99.76 Favored Pre-proline 0 CA--C 1.557 1.215 0 N-CA-C 114.458 1.281 . . . . 73.0 114.458 177.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.3 -12.21 31.47 Favored 'Trans proline' 0 C--N 1.384 2.401 0 C-N-CA 121.815 1.677 . . . . 75.310000000000002 113.999 173.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.751 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 74.3 m-85 -96.77 -7.84 32.75 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.36 0.264 . . . . 75.510000000000005 111.24 -178.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.3 mtt -83.05 154.91 24.18 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.317 0.58 . . . . 73.349999999999994 111.846 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.74 158.93 35.23 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 114.386 -1.279 . . . . 43.450000000000003 109.048 171.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -47.69 -38.94 16.16 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.753 1.221 . . . . 74.319999999999993 113.819 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.18 -51.69 42.87 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 123.352 0.407 . . . . 64.239999999999995 111.697 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.465 ' HG3' HD13 ' A' ' 11' ' ' LEU . 0.5 OUTLIER -73.74 -28.23 61.58 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.867 0.691 . . . . 74.0 112.867 -173.672 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -68.03 -55.72 11.55 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 123.686 0.794 . . . . 75.299999999999997 111.566 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -70.73 -29.23 65.44 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.855 0.687 . . . . 71.319999999999993 112.855 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.2 tp -63.8 -38.91 92.86 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 123.734 0.646 . . . . 75.420000000000002 110.7 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.473 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -60.86 -37.05 80.76 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 113.711 1.004 . . . . 75.209999999999994 113.711 -175.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.62 -37.12 86.47 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.39 0.431 . . . . 51.109999999999999 110.743 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -80.07 -31.75 39.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.666 -0.697 . . . . 75.25 111.327 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.1 m -69.66 -43.11 73.24 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 122.856 0.463 . . . . 53.210000000000001 110.355 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.765 HD22 ' HG2' ' A' ' 24' ' ' MET . 85.9 mt -68.75 -29.39 67.78 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.654 -0.703 . . . . 72.310000000000002 111.731 178.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.79 -24.15 61.69 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 123.438 0.461 . . . . 73.409999999999997 111.474 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -87.52 -33.03 19.1 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.347 0.499 . . . . 72.409999999999997 112.347 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 34.8 pt -90.92 -13.93 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 112.894 0.702 . . . . 52.310000000000002 112.894 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -49.78 91.9 Favored Pre-proline 0 N--CA 1.48 1.067 0 CA-C-O 117.797 -1.097 . . . . 64.549999999999997 113.619 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -73.87 -10.73 23.37 Favored 'Trans proline' 0 C--N 1.384 2.435 0 C-N-CA 121.708 1.605 . . . . 75.439999999999998 113.213 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 ' HG2' ' A' ' 56' ' ' GLU . 78.0 mt -81.55 148.5 29.11 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.667 -0.494 . . . . 73.200000000000003 109.667 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.526 HG23 ' H ' ' A' ' 56' ' ' GLU . 7.1 t -77.95 167.52 21.35 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.399 -0.593 . . . . 65.200000000000003 109.399 170.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -66.79 -31.76 72.6 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.886 0.474 . . . . 74.409999999999997 110.415 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -73.31 -29.71 62.88 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.36 -0.837 . . . . 74.129999999999995 111.008 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.547 ' HG2' HD22 ' A' ' 52' ' ' LEU . 4.9 tp10 -66.73 -46.42 75.53 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.861 0.464 . . . . 74.209999999999994 109.793 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.635 ' HE1' HD13 ' A' ' 12' ' ' LEU . 76.0 t80 -67.36 -29.09 68.54 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 123.774 0.671 . . . . 62.450000000000003 111.552 177.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.64 -33.45 72.8 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.422 0.527 . . . . 52.340000000000003 112.422 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -80.51 -29.5 37.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.319 -0.4 . . . . 75.420000000000002 111.514 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.0 mt -104.01 16.7 25.7 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.705 0.631 . . . . 64.129999999999995 112.705 -171.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.75 -69.97 0.1 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 62.299999999999997 113.294 -169.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mp -121.68 89.55 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 107.227 -1.398 . . . . 71.400000000000006 107.227 169.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -90.02 -64.98 1.06 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.997 -1.456 . . . . 64.049999999999997 109.945 -178.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.611 ' H ' HG21 ' A' ' 9' ' ' THR . . . -121.35 96.34 5.05 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.37 -0.377 . . . . 75.319999999999993 110.853 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.61 0 CA-C-O 120.904 0.383 . . . . 73.0 110.546 175.031 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt . . . . . 0 CA--C 1.517 -0.29 0 CA-C-O 120.474 0.178 . . . . 73.430000000000007 110.694 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.1 t -88.56 170.69 10.65 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.014 -0.736 . . . . 70.230000000000004 109.014 173.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -66.79 -30.97 51.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.039 0.535 . . . . 72.329999999999998 111.185 -172.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.406 ' O ' HD21 ' A' ' 41' ' ' LEU . 1.9 mp0 -62.74 -49.82 73.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.252 0.621 . . . . 65.230000000000004 111.708 177.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -66.06 -39.27 89.95 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.429 0.691 . . . . 75.109999999999999 111.864 -175.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.401 ' HA ' HD12 ' A' ' 12' ' ' LEU . 3.8 p -74.63 -26.34 59.82 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.855 0.687 . . . . 71.120000000000005 112.855 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -67.76 -32.48 73.11 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.052 0.541 . . . . 64.310000000000002 110.919 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.477 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 16.6 tp -64.55 -39.58 94.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.409 0.684 . . . . 52.509999999999998 111.048 172.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 9' ' ' THR . 55.4 mt -69.53 -32.14 70.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.381 -0.827 . . . . 74.400000000000006 111.037 178.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.529 ' HA ' HD12 ' A' ' 62' ' ' ILE . 22.6 t -69.37 -24.85 63.93 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 51.420000000000002 111.867 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.8 mt -67.19 -44.27 87.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 122.691 0.396 . . . . 72.150000000000006 110.341 174.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.449 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 95.5 m-85 -95.98 -86.84 0.3 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.313 0.486 . . . . 75.299999999999997 112.313 -175.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.551 ' HA ' HD21 ' A' ' 23' ' ' LEU . 13.4 t-20 53.87 85.32 0.05 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.905 1.282 . . . . 64.049999999999997 112.041 -171.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -88.82 -81.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.182 -0.463 . . . . 74.409999999999997 111.104 -177.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -163.52 53.6 0.29 Allowed Glycine 0 CA--C 1.499 -0.937 0 N-CA-C 110.5 -1.04 . . . . 73.099999999999994 110.5 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.83 -175.28 16.24 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.729 -0.948 . . . . 65.519999999999996 110.729 -175.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.458 ' HD3' HG22 ' A' ' 49' ' ' ILE . 3.0 pptp? -83.92 -18.54 37.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.696 0.248 . . . . 71.129999999999995 111.565 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.53 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 22.5 ttm180 -65.25 -52.18 56.09 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 123.824 0.702 . . . . 73.450000000000003 109.319 172.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.76 -29.6 75.46 Favored Glycine 0 N--CA 1.449 -0.467 0 O-C-N 124.516 1.135 . . . . 54.539999999999999 113.378 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.3 mm? -64.07 -42.31 97.02 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 116.901 0.351 . . . . 53.240000000000002 110.925 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.657 ' HG2' HD22 ' A' ' 46' ' ' LEU . 64.0 mtt -69.07 -41.19 77.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.848 0.314 . . . . 74.230000000000004 111.848 178.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 7.5 mm-40 -65.01 -36.24 83.76 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.61 0.243 . . . . 74.299999999999997 111.48 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.449 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.9 m-80 -78.85 -44.1 23.66 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 112.56 0.578 . . . . 72.349999999999994 112.56 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.419 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 52.6 mt -64.55 -51.34 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 119.17 -0.443 . . . . 71.209999999999994 111.837 -178.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -62.41 -37.52 86.11 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.145 0.794 . . . . 62.409999999999997 113.145 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.69 -30.13 27.02 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.491 0.552 . . . . 72.430000000000007 112.491 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.528 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -104.47 19.54 20.12 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.229 0.455 . . . . 71.439999999999998 112.229 -175.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 89.5 mt -55.05 -45.36 99.85 Favored Pre-proline 0 CA--C 1.559 1.292 0 N-CA-C 113.629 0.974 . . . . 62.409999999999997 113.629 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -67.89 -13.55 38.79 Favored 'Trans proline' 0 C--N 1.394 2.952 0 C-N-CA 122.063 1.842 . . . . 74.230000000000004 114.094 174.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.528 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.9 m-85 -92.03 -10.44 39.19 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.517 0.198 . . . . 75.340000000000003 111.158 178.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.0 mtm -99.95 -177.97 3.71 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.34 0.59 . . . . 71.329999999999998 111.902 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.37 159.86 28.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.03 -0.987 . . . . 74.430000000000007 110.23 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.57 -36.59 83.02 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.203 0.601 . . . . 52.399999999999999 111.596 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.45 -35.93 73.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.078 0.466 . . . . 65.209999999999994 110.254 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -25.98 61.33 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.456 -0.793 . . . . 53.32 111.839 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 -68.82 -41.83 78.07 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.117 0.567 . . . . 55.109999999999999 110.838 177.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -73.04 -31.74 64.63 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.324 -0.398 . . . . 74.239999999999995 111.652 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.406 HD21 ' O ' ' A' ' 7' ' ' GLU . 42.9 tp -68.17 -34.66 76.71 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.046 -0.525 . . . . 74.540000000000006 111.062 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.477 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -59.0 -41.37 87.49 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 123.625 0.77 . . . . 61.109999999999999 112.566 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -66.47 -35.26 79.83 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 123.828 0.705 . . . . 74.430000000000007 111.493 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -69.88 -42.82 72.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.963 -0.562 . . . . 72.319999999999993 111.447 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.0 m -72.53 -36.75 68.38 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.684 0.615 . . . . 73.219999999999999 111.195 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.657 HD22 ' HG2' ' A' ' 24' ' ' MET . 82.5 mt -67.37 -28.32 67.85 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.196 0.443 . . . . 64.409999999999997 112.196 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.9 61.35 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.762 0.315 . . . . 73.030000000000001 111.534 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -83.7 -32.91 25.3 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.963 0.505 . . . . 71.219999999999999 111.315 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.712 HG23 HD12 ' A' ' 52' ' ' LEU . 7.3 mt -94.54 -10.86 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 121.245 0.545 . . . . 73.140000000000001 110.797 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.65 -45.77 99.91 Favored Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 114.509 1.3 . . . . 61.399999999999999 114.509 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -77.63 -1.88 12.04 Favored 'Trans proline' 0 C--N 1.388 2.61 0 CA-C-N 121.854 1.698 . . . . 72.129999999999995 113.605 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.712 HD12 HG23 ' A' ' 49' ' ' ILE . 57.7 mt -86.56 140.79 29.55 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.061 -0.718 . . . . 61.310000000000002 109.061 174.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 t -84.22 170.37 13.81 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 108.521 -0.918 . . . . 65.010000000000005 108.521 168.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.464 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 15.0 tp10 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.687 0.795 . . . . 64.129999999999995 112.88 -166.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -75.29 -28.2 59.64 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.216 -0.902 . . . . 75.540000000000006 112.497 -173.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.65 -52.18 66.63 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.573 0.546 . . . . 71.340000000000003 112.273 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -69.12 -24.75 64.15 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.624 0.578 . . . . 71.129999999999995 111.841 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.4 -29.45 70.51 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 111.798 0.296 . . . . 71.040000000000006 111.798 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -81.99 -15.03 55.1 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.589 0.589 . . . . 74.310000000000002 112.589 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.35 -52.21 6.37 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.363 -0.21 . . . . 73.420000000000002 110.675 175.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 57.66 -101.05 0.12 Allowed 'General case' 0 C--N 1.354 0.796 0 O-C-N 125.168 1.542 . . . . 62.240000000000002 111.457 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.529 HD12 ' HA ' ' A' ' 13' ' ' SER . 40.1 mm -113.89 90.94 1.61 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 107.635 -1.246 . . . . 63.130000000000003 107.635 169.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -96.28 105.27 17.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.916 -0.772 . . . . 72.25 108.916 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 70.66 -166.13 0.15 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 125.4 1.48 . . . . 72.340000000000003 109.995 -166.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.685 0 C-N-CA 126.121 1.768 . . . . 55.340000000000003 114.866 173.197 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 70.9 mt . . . . . 0 C--O 1.238 0.461 0 N-CA-C 110.256 -0.276 . . . . 63.350000000000001 110.256 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.9 t -84.3 170.24 13.87 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.602 -0.518 . . . . 74.329999999999998 109.602 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.63 -33.71 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.656 0.782 . . . . 71.409999999999997 111.014 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.41 -34.82 65.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.259 0.466 . . . . 73.340000000000003 112.259 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 53.8 mt-10 -70.15 -39.59 75.28 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.419 0.155 . . . . 62.310000000000002 111.419 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.504 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.5 m -73.91 -28.03 61.33 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 123.562 0.539 . . . . 72.239999999999995 110.815 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -65.62 -41.61 92.51 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.949 0.5 . . . . 74.329999999999998 110.334 174.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' A' ' 42' ' ' ALA . 51.4 tp -68.15 -34.6 76.64 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.244 -0.889 . . . . 73.549999999999997 111.256 177.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 91.5 mt -65.1 -36.02 82.96 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 115.656 -0.702 . . . . 70.109999999999999 111.656 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.1 m -65.62 -28.28 69.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 123.811 0.694 . . . . 75.310000000000002 112.148 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.411 HD12 ' HA ' ' A' ' 11' ' ' LEU . 55.4 mt -71.39 -37.78 66.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.003 0.521 . . . . 72.409999999999997 110.945 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -119.11 27.33 8.91 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.742 0.275 . . . . 72.409999999999997 111.742 -174.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.527 ' HA ' HD21 ' A' ' 23' ' ' LEU . 9.7 t30 -76.94 101.21 5.87 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.058 -0.519 . . . . 53.240000000000002 111.736 -172.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.458 ' HG3' HD21 ' A' ' 26' ' ' ASN . 26.8 mm-40 -118.66 -117.88 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.488 -0.778 . . . . 75.109999999999999 112.249 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -96.64 87.83 0.96 Allowed Glycine 0 C--N 1.341 0.84 0 C-N-CA 121.325 -0.464 . . . . 43.219999999999999 112.985 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.28 -150.91 46.16 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 111.645 -0.582 . . . . 51.210000000000001 111.645 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.644 ' HG2' ' HB3' ' A' ' 54' ' ' GLU . 4.7 pttp -85.38 -17.39 36.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.751 -0.38 . . . . 72.239999999999995 110.431 175.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -67.45 -48.84 66.07 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.894 -0.593 . . . . 71.129999999999995 109.942 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.35 -33.08 86.29 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 123.89 0.744 . . . . 72.349999999999994 113.342 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.527 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.9 mm? -64.8 -51.78 60.38 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.9 0.35 . . . . 73.510000000000005 111.894 176.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.5 mtp -70.77 -34.6 71.98 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.457 0.473 . . . . 74.230000000000004 111.648 -173.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -66.45 -43.85 84.42 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 111.974 0.361 . . . . 74.129999999999995 111.974 175.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.458 HD21 ' HG3' ' A' ' 17' ' ' GLU . 79.1 m-20 -69.4 -40.87 77.08 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 112.523 0.564 . . . . 74.109999999999999 112.523 -178.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.496 ' CG2' ' HB1' ' A' ' 42' ' ' ALA . 63.8 mt -65.89 -44.75 92.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 119.149 -0.453 . . . . 51.310000000000002 111.426 -177.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.427 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 49.2 m-80 -70.12 -25.78 63.65 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.562 0.579 . . . . 70.319999999999993 112.562 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.86 -27.97 33.23 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 111.655 0.243 . . . . 74.099999999999994 111.655 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -98.28 7.65 45.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.934 0.346 . . . . 73.439999999999998 111.934 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.427 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 89.2 mt -58.55 -45.38 99.67 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-O 118.3 -0.857 . . . . 71.129999999999995 112.955 173.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -64.0 -5.77 9.89 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 122.567 2.178 . . . . 53.420000000000002 114.598 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -108.23 -134.56 0.34 Allowed 'General case' 0 C--O 1.242 0.665 0 N-CA-C 108.172 -1.047 . . . . 63.130000000000003 108.172 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtt 61.11 -105.44 0.2 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.784 1.234 . . . . 62.439999999999998 110.875 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -159.19 -69.08 0.08 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.933 0.893 . . . . 71.409999999999997 109.355 172.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 176.01 -40.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.478 1.511 . . . . 71.310000000000002 108.507 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.22 -50.39 63.96 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.864 -1.062 . . . . 54.520000000000003 110.222 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 42.9 mtp -64.37 -27.9 69.33 Favored 'General case' 0 C--O 1.209 -1.066 0 O-C-N 123.839 0.712 . . . . 73.519999999999996 112.212 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -73.73 -49.76 24.04 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.448 0.468 . . . . 73.109999999999999 111.705 -176.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -72.47 -32.0 65.88 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.85 0.315 . . . . 73.420000000000002 111.85 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.4 tp -69.12 -33.62 73.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.087 -0.506 . . . . 51.119999999999997 110.7 174.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.496 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -66.37 -31.67 72.58 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-N 116.006 -0.543 . . . . 63.200000000000003 112.084 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -70.38 -31.49 68.75 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.623 0.577 . . . . 75.019999999999996 111.381 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 44' ' ' ARG . 43.8 mtt180 -71.05 -38.69 72.53 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.284 0.365 . . . . 75.409999999999997 111.55 173.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.487 ' O ' HG13 ' A' ' 49' ' ' ILE . 13.8 m -73.56 -33.92 64.92 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 123.537 0.523 . . . . 70.450000000000003 111.227 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 90.1 mt -67.09 -31.92 72.73 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.547 0.339 . . . . 71.319999999999993 111.638 174.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.52 -20.34 62.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 123.582 0.551 . . . . 71.349999999999994 111.635 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 0.2 OUTLIER -81.22 -40.66 23.48 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.621 -0.263 . . . . 70.420000000000002 111.091 176.67 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.493 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.0 mt -89.73 -15.86 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 112.215 0.45 . . . . 71.430000000000007 112.215 -172.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -47.51 98.57 Favored Pre-proline 0 CA--C 1.555 1.17 0 N-CA-C 114.13 1.159 . . . . 71.140000000000001 114.13 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.21 0.97 9.32 Favored 'Trans proline' 0 C--N 1.378 2.107 0 CA-C-N 121.855 1.698 . . . . 42.5 113.789 174.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' A' ' 49' ' ' ILE . 88.0 mt -87.23 158.08 19.18 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.033 0.444 . . . . 45.399999999999999 110.367 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.624 HG23 ' H ' ' A' ' 56' ' ' GLU . 7.5 t -102.02 158.49 16.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.748 -0.834 . . . . 73.010000000000005 108.748 169.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.644 ' HB3' ' HG2' ' A' ' 20' ' ' LYS . 4.8 pt-20 -87.2 -4.4 59.1 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.719 0.295 . . . . 74.319999999999993 111.064 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.04 -45.44 70.44 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.563 -0.744 . . . . 55.119999999999997 109.516 166.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.624 ' H ' HG23 ' A' ' 53' ' ' THR . 29.8 tt0 -76.93 -34.35 57.67 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.889 -0.596 . . . . 74.150000000000006 110.854 177.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.417 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 54.9 t80 -67.4 -25.08 65.77 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 123.271 0.357 . . . . 72.329999999999998 110.998 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.05 -37.99 81.97 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.094 -0.379 . . . . 64.239999999999995 111.246 174.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -79.87 -19.94 47.08 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.386 0.513 . . . . 71.209999999999994 112.386 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 83.3 mt -84.06 -68.23 0.73 Allowed 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.854 -0.424 . . . . 73.530000000000001 109.854 173.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.82 -127.7 2.36 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 125.525 1.53 . . . . 64.230000000000004 111.452 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 39.4 mm -99.34 95.34 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 107.974 -1.121 . . . . 63.140000000000001 107.974 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -106.34 -7.44 17.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.278 -0.874 . . . . 75.299999999999997 111.303 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.504 ' H ' HG21 ' A' ' 9' ' ' THR . . . -137.12 -172.84 3.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.677 -0.861 . . . . 72.450000000000003 108.677 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.329 0 C-N-CA 124.854 1.262 . . . . 51.0 111.802 -175.467 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 5.1 mp . . . . . 0 C--O 1.238 0.485 0 N-CA-C 107.723 -1.214 . . . . 63.409999999999997 107.723 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.703 HG22 ' HG3' ' A' ' 8' ' ' GLU . 4.2 t -76.14 171.54 14.33 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 109.472 -0.566 . . . . 73.219999999999999 109.472 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 9.1 mm -61.78 -36.67 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.142 0.577 . . . . 74.439999999999998 111.859 -170.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.02 -24.9 59.62 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.172 0.805 . . . . 72.420000000000002 113.172 176.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.703 ' HG3' HG22 ' A' ' 5' ' ' THR . 46.7 mt-10 -75.42 -38.78 59.62 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 117.762 0.256 . . . . 61.299999999999997 111.053 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.12 -28.68 62.4 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.464 0.478 . . . . 74.299999999999997 111.871 174.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.449 ' O ' HG13 ' A' ' 14' ' ' ILE . 14.5 t-20 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.472 0.482 . . . . 71.230000000000004 110.652 170.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.466 ' HA ' HD12 ' A' ' 14' ' ' ILE . 49.2 tp -64.74 -33.6 76.35 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 124.028 0.83 . . . . 74.400000000000006 111.646 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.595 ' HA ' HD11 ' A' ' 23' ' ' LEU . 81.1 mt -59.59 -47.74 84.38 Favored 'General case' 0 C--O 1.214 -0.812 0 O-C-N 124.032 0.833 . . . . 62.340000000000003 111.731 175.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 46.2 p -71.55 -23.2 61.72 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.711 0.634 . . . . 71.239999999999995 112.711 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.466 HD12 ' HA ' ' A' ' 11' ' ' LEU . 87.9 mt -64.73 -51.52 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 122.766 0.426 . . . . 72.5 111.278 175.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.551 ' HB2' HD13 ' A' ' 23' ' ' LEU . 68.9 m-85 -106.3 29.8 6.51 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.057 0.392 . . . . 73.25 112.057 -174.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 14.7 t-20 -84.09 102.45 12.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.247 -0.433 . . . . 63.539999999999999 111.415 -176.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -123.22 -26.7 4.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.855 -0.611 . . . . 73.120000000000005 111.74 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.12 69.5 0.17 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.698 -0.763 . . . . 64.519999999999996 112.055 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.83 -149.28 46.12 Favored Glycine 0 N--CA 1.45 -0.372 0 O-C-N 123.859 0.388 . . . . 52.009999999999998 112.439 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.854 ' HE3' ' HA ' ' A' ' 53' ' ' THR . 0.6 OUTLIER -90.4 -11.17 41.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.741 0.305 . . . . 64.219999999999999 110.436 178.824 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -65.5 -52.86 49.7 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 123.963 0.905 . . . . 73.120000000000005 109.283 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.8 -30.34 74.4 Favored Glycine 0 C--O 1.218 -0.888 0 CA-C-N 114.966 -1.015 . . . . 41.5 112.622 174.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.716 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -62.28 -46.95 86.47 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 117.15 0.475 . . . . 63.109999999999999 111.353 175.32 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.614 ' HG2' HD22 ' A' ' 46' ' ' LEU . 46.3 mtt -63.72 -43.77 95.56 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.242 0.617 . . . . 74.340000000000003 112.369 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.11 -36.0 64.19 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.584 0.553 . . . . 75.329999999999998 112.02 -176.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -74.54 -33.67 62.79 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 119.534 -0.27 . . . . 64.019999999999996 111.52 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.488 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 11.9 mt -66.6 -49.73 72.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-O 119.282 -0.39 . . . . 71.040000000000006 111.17 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -65.27 -35.59 81.5 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.436 0.532 . . . . 74.439999999999998 112.436 -177.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.62 -34.53 58.35 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 111.971 0.359 . . . . 60.119999999999997 111.971 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.732 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.11 17.34 21.39 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 112.676 0.621 . . . . 75.010000000000005 112.676 -176.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 70.3 mt -57.83 -44.44 99.41 Favored Pre-proline 0 CA--C 1.554 1.134 0 N-CA-C 113.673 0.99 . . . . 73.310000000000002 113.673 172.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -69.61 -15.97 37.93 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 121.931 1.754 . . . . 55.310000000000002 113.787 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.732 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 99.4 m-85 -92.03 -9.95 40.94 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.566 0.346 . . . . 72.219999999999999 111.616 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.533 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 65.7 mtt -85.28 162.77 18.98 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.294 0.569 . . . . 65.430000000000007 111.309 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.89 149.98 37.67 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 107.064 -1.458 . . . . 74.109999999999999 107.064 160.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.63 -25.13 66.07 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.081 0.771 . . . . 75.299999999999997 113.081 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -66.46 -48.53 69.63 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.69 0.618 . . . . 75.109999999999999 111.095 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 31.8 ttp -77.42 -24.29 50.44 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.501 -0.772 . . . . 75.510000000000005 111.155 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.437 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 57.4 ttt180 -63.52 -53.03 58.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.78 1.232 . . . . 75.129999999999995 111.878 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.696 0.398 . . . . 71.329999999999998 112.059 174.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.4 tp -61.94 -39.0 90.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 122.524 0.33 . . . . 70.030000000000001 110.707 172.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.402 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -66.3 -30.18 70.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.187 0.995 . . . . 50.399999999999999 112.329 177.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.469 ' HA ' ' HD3' ' A' ' 43' ' ' LYS . 14.2 tppt? -65.46 -39.47 92.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.347 -0.842 . . . . 70.099999999999994 110.453 175.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.403 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 20.8 mmt180 -71.06 -38.56 72.49 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.654 -0.703 . . . . 50.240000000000002 111.85 176.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.47 ' O ' HG13 ' A' ' 49' ' ' ILE . 33.3 m -67.86 -40.4 83.63 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.665 0.603 . . . . 74.200000000000003 111.647 -177.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.614 HD22 ' HG2' ' A' ' 24' ' ' MET . 21.4 mt -70.06 -28.76 65.71 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.949 0.351 . . . . 62.030000000000001 111.949 178.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.09 -25.57 62.67 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 123.423 0.452 . . . . 72.219999999999999 111.427 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 43.5 mmtm -73.72 -49.38 25.89 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 122.433 0.293 . . . . 71.530000000000001 111.327 176.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.514 HD11 HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -95.42 3.45 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 112.285 0.476 . . . . 75.200000000000003 112.285 -169.504 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.415 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . . . -52.64 -48.69 89.68 Favored Pre-proline 0 CA--C 1.556 1.206 0 N-CA-C 114.019 1.118 . . . . 72.549999999999997 114.019 171.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.415 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 2.8 Cg_exo -80.59 -3.81 12.63 Favored 'Trans proline' 0 C--N 1.379 2.157 0 CA-C-N 121.917 1.72 . . . . 74.540000000000006 113.977 173.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.463 ' HB2' HG22 ' A' ' 49' ' ' ILE . 77.5 mt -104.86 81.72 1.79 Allowed 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.086 0.469 . . . . 64.430000000000007 110.195 -177.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.854 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 2.7 t -87.13 87.68 7.51 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.165 0.802 . . . . 74.409999999999997 113.165 -173.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.436 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 17.0 mm-40 79.72 -66.15 0.17 Allowed 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.976 1.31 . . . . 75.019999999999996 113.395 162.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -70.91 -31.19 67.73 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.475 0.71 . . . . 73.420000000000002 110.242 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.417 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 1.8 mm-40 -76.52 -28.35 56.33 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.564 -0.744 . . . . 74.540000000000006 110.505 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -72.03 -25.54 61.85 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.496 0.718 . . . . 72.150000000000006 110.765 174.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.26 -20.69 61.49 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 111.969 0.359 . . . . 74.109999999999999 111.969 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.16 -41.61 84.17 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.189 0.519 . . . . 71.230000000000004 110.766 168.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.544 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.0 mt -85.93 -61.46 1.75 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.823 -1.08 . . . . 73.430000000000007 110.607 -171.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.17 35.34 19.6 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 124.902 1.376 . . . . 73.319999999999993 112.772 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp 64.39 104.9 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.948 1.299 . . . . 64.200000000000003 110.767 -172.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 13.2 m-85 -93.21 -60.97 1.66 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.729 -0.669 . . . . 71.420000000000002 111.675 177.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -87.27 80.12 8.33 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.865 0.84 . . . . 72.310000000000002 112.122 -171.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 115.101 -0.954 . . . . 43.409999999999997 110.657 177.581 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 77.6 mt . . . . . 0 N--CA 1.446 -0.651 0 N-CA-C 110.039 -0.356 . . . . 63.130000000000003 110.039 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.09 161.8 29.65 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.512 -0.551 . . . . 35.140000000000001 109.512 168.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.418 ' HA ' ' OG1' ' A' ' 9' ' ' THR . 13.5 mm -80.28 -9.26 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.275 0.56 . . . . 73.510000000000005 110.908 -175.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.09 -34.78 73.58 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.905 -0.497 . . . . 71.430000000000007 110.58 169.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.2 mm-40 -66.29 -49.14 68.09 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.756 0.66 . . . . 60.43 109.343 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.455 ' HB ' HG23 ' A' ' 62' ' ' ILE . 1.9 p -69.87 -26.89 64.41 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 123.943 0.777 . . . . 60.409999999999997 112.884 -177.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.31 -40.4 77.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.511 0.195 . . . . 71.239999999999995 111.056 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.1 tp -67.35 -38.94 85.62 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.225 0.61 . . . . 64.140000000000001 110.824 174.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 92.1 mt -65.71 -31.81 73.02 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.14 -0.937 . . . . 75.25 112.003 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -69.53 -32.26 70.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.369 0.668 . . . . 71.299999999999997 111.762 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 74.9 mt -68.77 -46.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 120.955 0.407 . . . . 73.209999999999994 110.283 178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -105.29 26.97 8.73 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.864 0.691 . . . . 74.409999999999997 112.864 -173.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.686 ' HA ' HD21 ' A' ' 23' ' ' LEU . 66.2 t30 -71.09 103.92 2.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.323 0.583 . . . . 71.519999999999996 111.263 -175.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -90.68 -22.7 21.02 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.646 -1.161 . . . . 74.0 109.892 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.03 -38.23 1.63 Allowed Glycine 0 C--N 1.336 0.555 0 C-N-CA 120.847 -0.692 . . . . 54.240000000000002 113.269 177.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.46 ' HA3' ' OE2' ' A' ' 54' ' ' GLU . . . -137.38 179.66 17.86 Favored Glycine 0 CA--C 1.504 -0.621 0 C-N-CA 121.174 -0.536 . . . . 54.240000000000002 111.967 -177.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.716 ' HD3' HG22 ' A' ' 49' ' ' ILE . 0.6 OUTLIER -77.59 -29.2 51.9 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 116.9 0.35 . . . . 74.129999999999995 110.904 -172.538 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -66.51 -47.84 71.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.835 0.71 . . . . 74.400000000000006 110.371 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.51 -32.88 82.97 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.637 -0.711 . . . . 64.349999999999994 113.265 176.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.686 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.1 mm? -67.72 -40.65 84.23 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.35 0.5 . . . . 44.409999999999997 112.35 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.404 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 96.0 mtp -69.36 -28.91 66.61 Favored 'General case' 0 C--O 1.219 -0.544 0 O-C-N 123.053 0.22 . . . . 73.109999999999999 111.582 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -73.43 -43.46 60.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.191 0.196 . . . . 54.140000000000001 111.359 173.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.17 -42.53 99.42 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 74.239999999999995 111.867 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.745 HG23 ' HB1' ' A' ' 42' ' ' ALA . 83.1 mt -71.82 -42.85 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.053 -0.521 . . . . 75.409999999999997 111.518 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 24' ' ' MET . 7.1 t-20 -62.62 -41.6 99.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.184 0.594 . . . . 74.5 111.96 -176.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.98 -34.6 50.83 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.91 -0.586 . . . . 74.209999999999994 112.049 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -97.18 18.03 15.88 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 113.242 0.83 . . . . 73.310000000000002 113.242 -171.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -54.02 -53.22 60.79 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 113.51 0.93 . . . . 44.210000000000001 113.51 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -76.24 -7.83 18.26 Favored 'Trans proline' 0 C--N 1.382 2.329 0 CA-C-N 121.18 1.457 . . . . 73.200000000000003 113.954 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.518 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 92.5 m-85 -90.01 -30.91 17.45 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 122.518 0.327 . . . . 72.540000000000006 111.769 -175.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.523 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 63.5 mtt -67.53 -75.78 0.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 122.969 0.508 . . . . 65.430000000000007 111.817 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.416 ' HB3' ' HB2' ' A' ' 38' ' ' MET . 18.7 t70 179.64 169.74 1.11 Allowed 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 104.96 -2.237 . . . . 44.119999999999997 104.96 -172.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.07 -40.04 47.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 119.04 0.836 . . . . 64.140000000000001 110.852 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.49 -41.7 72.33 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.225 0.536 . . . . 73.340000000000003 111.027 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.416 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 4.2 tpt -69.97 -26.84 64.29 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 114.96 -1.018 . . . . 72.510000000000005 111.22 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -69.14 -42.69 75.66 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.477 0.711 . . . . 74.439999999999998 111.552 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -65.0 -34.56 78.72 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.562 0.539 . . . . 71.129999999999995 111.116 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.6 tp -66.11 -48.99 69.08 Favored 'General case' 0 C--O 1.216 -0.694 0 O-C-N 123.888 0.743 . . . . 71.319999999999993 110.444 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.745 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -58.85 -41.01 85.97 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.628 1.171 . . . . 60.219999999999999 114.06 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -67.03 -34.89 78.69 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.337 0.398 . . . . 73.310000000000002 111.69 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -76.27 -34.23 59.14 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 74.010000000000005 111.443 178.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.458 HG22 HD11 ' A' ' 49' ' ' ILE . 7.5 m -65.85 -37.09 85.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.072 0.549 . . . . 61.140000000000001 110.741 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.74 -34.05 75.14 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.343 0.868 . . . . 74.010000000000005 113.343 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.18 -22.02 62.08 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.903 0.382 . . . . 55.210000000000001 111.62 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -88.5 -29.73 19.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.083 -0.508 . . . . 73.409999999999997 111.509 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.716 HG22 ' HD3' ' A' ' 20' ' ' LYS . 25.6 mt -91.95 -24.81 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 111.357 0.132 . . . . 65.420000000000002 111.357 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.02 -46.49 97.6 Favored Pre-proline 0 CA--C 1.557 1.213 0 N-CA-C 114.699 1.37 . . . . 73.530000000000001 114.699 177.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -80.31 3.89 7.28 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 121.64 1.56 . . . . 74.430000000000007 114.748 176.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.563 HD22 ' HG2' ' A' ' 56' ' ' GLU . 78.9 mt -88.79 169.14 11.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.444 -0.576 . . . . 74.120000000000005 109.444 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.5 p -103.58 174.27 5.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.376 -0.374 . . . . 73.510000000000005 110.314 173.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.46 ' OE2' ' HA3' ' A' ' 19' ' ' GLY . 54.4 tp10 -66.1 -36.51 83.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.886 -0.597 . . . . 74.430000000000007 110.565 175.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.484 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 52.0 m-80 -74.12 -32.68 63.29 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.828 -0.624 . . . . 65.200000000000003 111.859 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.563 ' HG2' HD22 ' A' ' 52' ' ' LEU . 8.0 tp10 -65.75 -37.03 85.25 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.805 0.442 . . . . 75.219999999999999 111.769 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.553 ' HB2' ' HB3' ' A' ' 20' ' ' LYS . 45.6 t80 -69.83 -32.95 71.65 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.4 -0.363 . . . . 53.329999999999998 110.654 176.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.25 -22.86 57.54 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.123 0.416 . . . . 63.210000000000001 112.123 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 13.9 mm-40 -68.0 -39.03 83.31 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.825 -0.435 . . . . 65.340000000000003 109.825 171.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.444 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 74.9 mt -71.58 -57.06 4.74 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 115.537 -0.756 . . . . 61.43 110.631 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 59.41 20.46 8.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.238 1.415 . . . . 73.150000000000006 112.788 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.455 HG23 ' HB ' ' A' ' 9' ' ' THR . 5.2 mp 56.63 88.37 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 124.767 1.227 . . . . 72.109999999999999 110.066 -167.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 55.5 m-85 -68.44 -42.04 79.44 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.44 -0.8 . . . . 73.230000000000004 111.344 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.401 ' HB3' HD12 ' A' ' 6' ' ' ILE . . . -122.21 106.8 11.46 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.774 -0.648 . . . . 51.439999999999998 111.926 -171.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.771 0 CA-C-N 115.679 -0.692 . . . . 63.229999999999997 109.946 169.689 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.548 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 76.1 mt . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 109.613 -0.514 . . . . 75.450000000000003 109.613 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 t -99.31 -174.49 2.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.916 -0.772 . . . . 72.219999999999999 108.916 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.466 HD12 ' H ' ' A' ' 6' ' ' ILE . 4.1 mp -63.85 -30.9 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.645 0.778 . . . . 71.019999999999996 112.324 -171.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -65.5 -47.17 76.91 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.642 0.377 . . . . 63.530000000000001 111.462 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.565 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 2.2 mp0 -68.38 -37.1 80.08 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.403 0.439 . . . . 65.420000000000002 111.542 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.4 m -73.73 -29.5 62.28 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 123.292 0.37 . . . . 55.25 111.478 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -69.55 -35.32 75.33 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.858 0.463 . . . . 70.209999999999994 110.461 173.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.501 HD21 ' HA ' ' A' ' 42' ' ' ALA . 14.3 tp -67.23 -40.24 86.34 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.164 -0.471 . . . . 72.019999999999996 110.813 174.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.634 ' HA ' HD11 ' A' ' 23' ' ' LEU . 88.5 mt -61.34 -38.95 88.78 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.763 0.665 . . . . 73.150000000000006 110.824 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 t -64.21 -34.01 77.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.114 0.966 . . . . 64.450000000000003 112.259 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 88.4 mt -74.29 -43.63 49.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 O-C-N 123.299 0.375 . . . . 64.239999999999995 111.228 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.492 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 78.9 m-85 -109.61 21.79 16.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.273 0.842 . . . . 75.010000000000005 113.273 -167.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.3 t30 -87.1 114.66 23.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.268 0.556 . . . . 74.519999999999996 111.361 -177.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.459 ' HB2' ' HA3' ' A' ' 22' ' ' GLY . 28.0 mm-40 -97.82 6.12 48.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.369 -0.832 . . . . 65.030000000000001 111.624 176.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.51 51.8 1.18 Allowed Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.914 -0.874 . . . . 61.130000000000003 110.914 -175.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.55 167.47 11.72 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.826 -0.509 . . . . 64.200000000000003 111.826 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.39 -18.12 57.59 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 111.918 0.34 . . . . 72.230000000000004 111.918 -176.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.472 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 48.0 ttm-85 -64.72 -44.1 91.29 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.514 -0.766 . . . . 62.530000000000001 109.776 176.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.459 ' HA3' ' HB2' ' A' ' 17' ' ' GLU . . . -61.22 -31.61 77.6 Favored Glycine 0 C--N 1.341 0.838 0 O-C-N 124.014 0.821 . . . . 62.409999999999997 113.612 174.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.634 HD11 ' HA ' ' A' ' 12' ' ' LEU . 3.9 mm? -65.81 -43.63 88.09 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 122.548 0.339 . . . . 73.310000000000002 111.703 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 54.4 mtt -73.64 -35.4 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.156 0.428 . . . . 75.209999999999994 112.156 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 47.1 mm-40 -65.54 -50.35 65.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.647 0.261 . . . . 65.049999999999997 111.41 175.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.492 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.4 m-80 -69.71 -42.48 73.98 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.167 0.802 . . . . 63.350000000000001 113.167 -174.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.544 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 54.9 mt -68.73 -48.53 70.78 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.591 0 CA-C-O 118.84 -0.6 . . . . 74.329999999999998 111.763 -178.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -66.63 -30.19 70.41 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.361 0.875 . . . . 72.310000000000002 113.361 -175.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.29 -37.86 25.21 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.679 0.251 . . . . 31.140000000000001 111.679 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.704 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.43 19.09 15.06 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.579 0.585 . . . . 73.140000000000001 112.579 -174.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 51.6 mt -56.32 -51.99 76.61 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-O 118.12 -0.943 . . . . 62.340000000000003 112.48 173.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.5 -15.53 45.33 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.025 1.817 . . . . 71.519999999999996 114.027 174.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.704 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.7 m-85 -90.88 -5.01 56.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.941 0.496 . . . . 64.140000000000001 111.267 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 60.3 mtt -84.2 171.73 12.53 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.019 -0.363 . . . . 64.519999999999996 110.019 173.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -77.34 0.14 Allowed 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.384 -0.371 . . . . 70.329999999999998 111.216 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -175.94 -47.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.11 0.964 . . . . 60.210000000000001 108.779 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.6 -42.41 82.49 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.11 -0.95 . . . . 64.340000000000003 109.912 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 2.0 tpt -71.65 -27.04 62.81 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.574 -0.739 . . . . 64.150000000000006 111.572 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 39' ' ' ARG . 42.2 ttm180 -74.98 -46.58 34.37 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.022 0.529 . . . . 75.219999999999999 111.591 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -62.89 -34.41 77.36 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.069 0.461 . . . . 73.019999999999996 111.471 175.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 tp -66.72 -41.63 87.62 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.224 -0.898 . . . . 71.409999999999997 110.902 175.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.501 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -63.64 -38.11 89.88 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.456 0.909 . . . . 72.150000000000006 113.456 -175.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -64.12 -42.91 96.66 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 123.636 0.585 . . . . 64.310000000000002 111.178 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -73.02 -34.6 66.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.709 -0.678 . . . . 74.299999999999997 112.334 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.423 ' O ' HG13 ' A' ' 49' ' ' ILE . 35.0 m -71.34 -41.39 69.88 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.599 -0.273 . . . . 73.109999999999999 110.971 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.2 mt -65.36 -29.38 70.1 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.656 0.613 . . . . 62.530000000000001 112.656 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.08 -19.74 62.43 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.156 0.428 . . . . 51.43 112.156 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -29.21 22.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.316 0.246 . . . . 65.219999999999999 111.609 176.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 45' ' ' THR . 4.2 mt -90.17 -14.79 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-O 120.851 0.358 . . . . 65.010000000000005 110.683 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -47.02 99.41 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 114.013 1.116 . . . . 72.329999999999998 114.013 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -75.58 7.05 3.26 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 121.675 1.583 . . . . 64.239999999999995 114.484 172.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.3 mt -106.19 174.26 5.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.886 0.374 . . . . 52.100000000000001 110.517 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.6 p -112.01 -168.11 1.27 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.69 -0.856 . . . . 72.510000000000005 108.69 167.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.36 -7.8 57.35 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.534 -0.173 . . . . 70.209999999999994 110.534 175.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -72.93 -47.73 43.14 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.703 -0.48 . . . . 73.0 109.703 170.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -71.27 -29.43 65.06 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.534 . . . . 64.340000000000003 111.701 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -69.42 -36.92 77.16 Favored 'General case' 0 C--O 1.217 -0.629 0 O-C-N 123.278 0.361 . . . . 74.340000000000003 110.597 174.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.16 -17.48 60.91 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.031 0.382 . . . . 72.409999999999997 112.031 -177.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -66.76 -37.29 84.33 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.117 -0.492 . . . . 74.230000000000004 110.826 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.551 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 43.2 mt -83.26 -59.65 2.4 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.72 -0.673 . . . . 71.040000000000006 110.799 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.87 -107.22 0.35 Allowed 'General case' 0 C--N 1.344 0.361 0 O-C-N 125.251 1.594 . . . . 44.43 110.67 -171.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 31.2 mm -126.1 98.64 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.674 -0.862 . . . . 73.049999999999997 108.674 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.551 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 4.7 m-85 -91.87 -85.94 0.24 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.172 -0.467 . . . . 71.109999999999999 111.927 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' ILE . . . -96.5 82.83 3.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.264 0.554 . . . . 75.200000000000003 110.99 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.591 0 CA-C-N 115.577 -0.738 . . . . 65.409999999999997 110.124 173.591 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 N--CA 1.443 -0.818 0 N-CA-C 108.624 -0.88 . . . . 73.329999999999998 108.624 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -74.01 156.94 37.0 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.584 -0.735 . . . . 73.209999999999994 109.519 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.1 mm -64.24 -32.85 59.13 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 122.64 0.376 . . . . 72.049999999999997 111.142 -177.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -69.7 -34.66 74.21 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.14 -0.482 . . . . 74.109999999999999 111.211 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 39.0 mt-10 -69.71 -41.82 74.86 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.584 0.553 . . . . 73.329999999999998 111.199 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.5 ' HA ' HD12 ' A' ' 12' ' ' LEU . 2.3 m -75.35 -24.89 57.38 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.482 0.489 . . . . 65.129999999999995 111.506 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.46 -36.74 81.75 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.259 -0.276 . . . . 73.019999999999996 110.863 169.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.549 HD13 ' HG2' ' A' ' 38' ' ' MET . 46.2 tp -64.66 -36.52 84.53 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.069 0.548 . . . . 64.299999999999997 110.074 173.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.776 ' HA ' HD11 ' A' ' 23' ' ' LEU . 81.7 mt -67.11 -39.64 86.71 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.259 -0.882 . . . . 73.420000000000002 111.091 173.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.408 ' HA ' HD12 ' A' ' 62' ' ' ILE . 22.8 t -69.41 -26.16 64.49 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.964 0.906 . . . . 75.519999999999996 112.919 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 73.8 mt -79.38 -35.23 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 122.277 0.231 . . . . 52.43 110.622 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -114.96 24.64 11.55 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.913 0.709 . . . . 74.230000000000004 112.913 -173.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 64.4 t30 -85.26 90.48 7.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.384 0.611 . . . . 54.229999999999997 110.112 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -114.67 -25.22 8.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.922 -1.035 . . . . 73.099999999999994 111.275 -176.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -169.87 64.86 0.17 Allowed Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.004 -1.093 . . . . 32.200000000000003 113.489 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.16 -155.49 47.67 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 111.608 -0.597 . . . . 65.530000000000001 111.608 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.494 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 2.6 pptp? -83.51 -11.71 57.12 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.211 0.505 . . . . 75.109999999999999 110.324 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 ttp85 -68.35 -53.27 25.21 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.194 -0.669 . . . . 74.310000000000002 109.194 170.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.9 -32.93 76.44 Favored Glycine 0 C--N 1.342 0.898 0 O-C-N 124.392 1.058 . . . . 60.130000000000003 113.442 173.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.776 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.6 mm? -68.14 -49.71 59.29 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 117.11 0.455 . . . . 61.420000000000002 112.196 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.507 ' HG2' HD22 ' A' ' 46' ' ' LEU . 50.7 mtt -66.72 -34.16 77.23 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.518 0.562 . . . . 71.519999999999996 112.518 -176.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -70.07 -51.22 33.7 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.33 0.252 . . . . 75.409999999999997 111.556 175.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -76.66 -29.25 56.3 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.997 0.74 . . . . 72.409999999999997 112.997 -170.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.464 HD11 HD12 ' A' ' 23' ' ' LEU . 60.6 mt -69.04 -50.45 53.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 117.88 0.309 . . . . 75.150000000000006 110.447 175.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -67.61 -33.33 74.78 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.113 0.783 . . . . 61.420000000000002 113.113 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.99 -33.48 61.86 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.776 0.322 . . . . 73.400000000000006 111.637 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.718 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.15 19.52 19.41 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.542 0.571 . . . . 71.409999999999997 112.542 -176.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.445 HD23 ' HE3' ' A' ' 34' ' ' MET . 61.1 mt -56.4 -50.12 89.47 Favored Pre-proline 0 CA--C 1.55 0.947 0 CA-C-O 118.266 -0.873 . . . . 74.109999999999999 112.502 171.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.99 -23.6 53.87 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 121.656 1.57 . . . . 73.329999999999998 113.923 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.718 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.0 m-85 -77.78 -36.46 50.43 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.803 0.441 . . . . 60.5 111.628 -177.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.445 ' HE3' HD23 ' A' ' 31' ' ' LEU . 22.3 ptp -82.21 168.81 17.28 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.714 0.292 . . . . 62.329999999999998 110.787 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -72.28 154.27 41.07 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.872 -0.603 . . . . 63.32 109.521 176.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 39' ' ' ARG . 29.1 tt0 -70.44 -20.19 62.92 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.673 0.619 . . . . 61.409999999999997 112.673 -175.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -65.77 -44.8 84.73 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.006 0.431 . . . . 72.329999999999998 110.415 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.549 ' HG2' HD13 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -76.27 -25.16 54.67 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.034 -0.985 . . . . 74.120000000000005 111.009 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.439 ' HB3' ' HA ' ' A' ' 36' ' ' GLU . 35.8 ttm180 -71.86 -44.71 63.34 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.3 1.04 . . . . 72.129999999999995 111.471 -179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -71.26 -29.95 65.71 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.742 0.417 . . . . 74.099999999999994 111.462 174.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -61.57 -34.05 74.92 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.201 -0.909 . . . . 75.349999999999994 111.381 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.48 75.89 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.548 0.944 . . . . 62.130000000000003 113.548 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.07 -38.8 92.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 73.140000000000001 110.434 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 44' ' ' ARG . 39.3 mtt180 -71.32 -53.53 13.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.959 -1.019 . . . . 54.140000000000001 112.213 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.8 m -61.41 -44.97 96.21 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.651 0.78 . . . . 70.150000000000006 112.733 -172.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.507 HD22 ' HG2' ' A' ' 24' ' ' MET . 96.3 mt -64.94 -27.43 68.84 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.783 0.661 . . . . 65.010000000000005 112.783 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.4 64.43 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.857 0.688 . . . . 73.430000000000007 112.857 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.32 -27.6 29.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.693 0.224 . . . . 60.130000000000003 110.997 177.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.446 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.0 mt -97.17 -12.09 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-O 121.041 0.448 . . . . 73.400000000000006 110.904 -173.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.12 97.57 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 114.341 1.237 . . . . 73.129999999999995 114.341 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -79.51 11.23 2.75 Favored 'Trans proline' 0 C--N 1.383 2.361 0 CA-C-N 122.152 1.804 . . . . 73.430000000000007 114.307 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 49' ' ' ILE . 95.8 mt -108.29 -179.66 3.95 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 122.762 0.425 . . . . 63.350000000000001 110.118 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.457 HG23 ' OD1' ' A' ' 55' ' ' ASN . 6.4 t -139.11 -169.95 2.77 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.471 -0.937 . . . . 73.450000000000003 108.471 174.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -64.79 -43.39 93.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.53 0.732 . . . . 71.340000000000003 112.7 -167.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.457 ' OD1' HG23 ' A' ' 53' ' ' THR . 30.7 p-10 -67.78 -32.45 73.03 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.678 0.612 . . . . 72.430000000000007 112.285 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -67.17 -41.64 85.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 123.733 0.646 . . . . 71.329999999999998 111.844 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.593 ' HE1' HD13 ' A' ' 12' ' ' LEU . 88.5 t80 -75.29 -38.46 60.36 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.477 0.486 . . . . 75.420000000000002 111.467 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.81 -24.04 66.83 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.807 1.04 . . . . 71.450000000000003 113.807 -168.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.08 -34.08 43.92 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.584 0.216 . . . . 73.299999999999997 111.584 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 mt -75.85 -56.38 4.73 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.238 -0.653 . . . . 73.049999999999997 109.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.58 -108.52 0.42 Allowed 'General case' 0 C--N 1.346 0.425 0 O-C-N 125.498 1.749 . . . . 73.209999999999994 113.17 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.408 HD12 ' HA ' ' A' ' 13' ' ' SER . 17.1 mm -113.2 88.31 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.072 -1.085 . . . . 55.020000000000003 108.072 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -103.64 -10.64 18.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.48 -0.782 . . . . 71.409999999999997 112.01 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -146.44 82.04 1.58 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 51.509999999999998 111.339 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.622 0 CA-C-N 115.552 -0.749 . . . . 64.040000000000006 109.192 170.128 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.597 HD21 ' HG3' ' A' ' 48' ' ' LYS . 85.7 mt . . . . . 0 CA--C 1.51 -0.561 0 CA-C-O 121.13 0.491 . . . . 72.299999999999997 111.527 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' HG2' ' A' ' 8' ' ' GLU . 14.9 t -90.3 166.78 13.13 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.389 -0.823 . . . . 55.520000000000003 109.004 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.3 mm -69.41 -27.35 33.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 116.228 -0.442 . . . . 64.230000000000004 110.715 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.54 -45.59 78.9 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.592 0.757 . . . . 71.209999999999994 112.378 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.479 ' HG2' HG22 ' A' ' 5' ' ' THR . 43.0 mm-40 -64.29 -43.91 93.27 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.556 0.535 . . . . 65.519999999999996 110.362 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.69 ' HA ' HD12 ' A' ' 12' ' ' LEU . 3.1 m -73.46 -26.54 60.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.777 -1.101 . . . . 61.210000000000001 111.325 -176.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.437 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.8 t-20 -69.44 -36.51 76.71 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.005 0.522 . . . . 73.140000000000001 111.45 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.623 HD12 HD12 ' A' ' 14' ' ' ILE . 38.0 tp -74.01 -33.17 63.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.879 0.371 . . . . 72.530000000000001 110.538 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.69 HD12 ' HA ' ' A' ' 9' ' ' THR . 69.4 mt -63.53 -35.32 80.07 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-N 115.634 -0.712 . . . . 74.530000000000001 110.622 170.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -70.68 -24.55 62.7 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.526 0.73 . . . . 74.230000000000004 111.988 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.623 HD12 HD12 ' A' ' 11' ' ' LEU . 96.6 mt -69.93 -34.38 59.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 123.006 0.522 . . . . 43.310000000000002 110.266 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -107.39 -84.95 0.52 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.26 -0.4 . . . . 70.530000000000001 111.309 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.606 ' HA ' HD21 ' A' ' 23' ' ' LEU . 64.3 t30 57.13 83.83 0.1 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.389 1.476 . . . . 62.0 111.829 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.478 ' H ' HD22 ' A' ' 23' ' ' LEU . 38.5 tt0 -149.53 123.63 9.46 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.763 -1.108 . . . . 72.409999999999997 110.03 -177.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.17 24.02 74.53 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 115.535 0.974 . . . . 71.420000000000002 115.535 167.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.92 -150.19 42.35 Favored Glycine 0 C--O 1.221 -0.695 0 C-N-CA 121.153 -0.546 . . . . 71.099999999999994 112.497 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 57' ' ' TYR . 14.2 tmtt? -64.97 -43.35 92.94 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.95 0.5 . . . . 73.129999999999995 111.085 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -72.81 -45.4 58.68 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.051 -0.977 . . . . 74.329999999999998 111.318 -172.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.38 -30.08 74.89 Favored Glycine 0 CA--C 1.524 0.627 0 O-C-N 123.757 0.661 . . . . 75.019999999999996 113.137 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' A' ' 16' ' ' ASN . 0.5 OUTLIER -64.24 -37.89 89.09 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.821 0.31 . . . . 71.420000000000002 110.905 173.664 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.654 ' HG2' HD22 ' A' ' 46' ' ' LEU . 37.8 mtt -69.42 -39.41 77.88 Favored 'General case' 0 C--O 1.221 -0.415 0 O-C-N 123.234 0.334 . . . . 74.319999999999993 111.505 175.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -63.71 -40.81 97.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.693 0.397 . . . . 61.530000000000001 111.723 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -77.98 -42.68 32.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.712 -0.676 . . . . 71.25 111.174 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.0 mt -72.63 -38.48 58.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 119.107 -0.473 . . . . 74.219999999999999 111.868 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -63.36 -35.76 81.47 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.254 0.479 . . . . 63.520000000000003 111.693 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -19.26 61.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.109 -0.496 . . . . 54.409999999999997 112.307 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.651 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -113.79 17.29 18.17 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.415 0.524 . . . . 52.140000000000001 112.415 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.51 -44.65 56.55 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 113.441 0.904 . . . . 75.219999999999999 113.441 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.26 7.95 2.74 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 121.709 1.606 . . . . 55.140000000000001 114.122 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.651 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 95.9 m-85 -114.29 -168.8 1.41 Allowed 'General case' 0 C--O 1.242 0.681 0 C-N-CA 123.12 0.568 . . . . 65.450000000000003 109.618 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 68.0 mtm 68.16 -88.81 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.309 1.444 . . . . 75.140000000000001 111.454 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -167.85 164.1 14.05 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 106.832 -1.544 . . . . 75.019999999999996 106.832 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.64 -31.71 71.91 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.043 0.383 . . . . 61.450000000000003 111.734 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.34 -39.01 55.06 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.0 0.52 . . . . 64.019999999999996 110.508 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 5.7 mtt -68.03 -28.51 67.46 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 115.914 -0.585 . . . . 54.25 111.882 174.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -71.04 -43.02 68.72 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 123.311 0.645 . . . . 62.210000000000001 111.156 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -67.98 -32.17 72.38 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 111.562 0.208 . . . . 73.230000000000004 111.562 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.72 -48.07 78.56 Favored 'General case' 0 C--O 1.213 -0.846 0 O-C-N 123.644 0.59 . . . . 72.439999999999998 109.653 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.63 -34.76 76.24 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.348 1.059 . . . . 53.130000000000003 113.537 -177.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -66.27 -35.97 81.79 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 123.688 0.617 . . . . 75.420000000000002 111.813 177.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -79.75 -28.98 40.38 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.468 0.48 . . . . 74.030000000000001 111.515 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 m -75.35 -30.66 60.31 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.945 0.402 . . . . 75.430000000000007 110.39 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.654 HD22 ' HG2' ' A' ' 24' ' ' MET . 67.6 mt -76.71 -31.16 57.02 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.182 0.438 . . . . 70.25 112.182 169.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.42 -33.12 73.65 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.743 0.645 . . . . 74.450000000000003 112.743 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.597 ' HG3' HD21 ' A' ' 4' ' ' LEU . 0.1 OUTLIER -86.4 -17.21 34.95 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.914 0.339 . . . . 71.310000000000002 111.914 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.53 HG22 HD12 ' A' ' 52' ' ' LEU . 31.7 pt -97.82 -8.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 120.415 -0.514 . . . . 64.400000000000006 112.005 174.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.66 -46.32 99.59 Favored Pre-proline 0 CA--C 1.557 1.216 0 CA-C-O 118.261 -0.876 . . . . 61.340000000000003 113.208 171.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.45 -5.91 15.92 Favored 'Trans proline' 0 C--N 1.381 2.266 0 CA-C-N 121.62 1.614 . . . . 65.120000000000005 114.139 171.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.53 HD12 HG22 ' A' ' 49' ' ' ILE . 76.7 mt -92.17 153.07 19.55 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.886 0.374 . . . . 61.420000000000002 110.115 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 p -95.01 -176.89 3.97 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.171 -0.468 . . . . 74.329999999999998 110.982 175.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.56 -30.28 69.87 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.902 -0.59 . . . . 75.549999999999997 111.362 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -71.72 -39.4 70.16 Favored 'General case' 0 C--O 1.226 -0.183 0 O-C-N 123.724 0.64 . . . . 72.040000000000006 110.527 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.3 -42.04 93.48 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 123.716 0.635 . . . . 64.530000000000001 112.711 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.486 ' HB3' ' HB2' ' A' ' 20' ' ' LYS . 80.1 t80 -75.58 -26.15 57.65 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.052 0.22 . . . . 73.120000000000005 111.218 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.96 -29.04 66.06 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.94 0.336 . . . . 70.5 111.341 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.38 -23.44 61.11 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 123.456 0.472 . . . . 75.319999999999993 111.811 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -93.75 -69.06 0.77 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.639 0.376 . . . . 71.310000000000002 111.808 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.94 -135.02 1.46 Allowed 'General case' 0 C--N 1.352 0.709 0 C-N-CA 124.741 1.216 . . . . 72.239999999999995 110.709 -172.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.4 mm -97.1 98.0 6.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.002 -1.111 . . . . 74.519999999999996 108.002 172.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -117.45 -9.6 10.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.334 -0.848 . . . . 71.219999999999999 111.794 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.94 -29.04 3.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.462 0.542 . . . . 74.140000000000001 112.462 -173.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.515 0 N-CA-C 112.901 0.704 . . . . 73.129999999999995 112.901 -174.469 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.8 mt . . . . . 0 CA--C 1.516 -0.363 0 CA-C-O 120.604 0.24 . . . . 35.329999999999998 110.401 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.8 p -87.33 169.8 11.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.163 -0.471 . . . . 63.25 110.836 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.404 HG12 ' HB1' ' A' ' 64' ' ' ALA . 50.5 mt -70.8 -22.49 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.743 -0.662 . . . . 71.430000000000007 109.803 177.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.42 -55.04 27.54 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.136 0.575 . . . . 74.329999999999998 111.22 174.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.01 -37.33 69.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.675 -0.693 . . . . 72.319999999999993 111.912 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.74 ' HA ' HD12 ' A' ' 12' ' ' LEU . 7.6 m -74.75 -27.82 60.51 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.402 -0.363 . . . . 64.299999999999997 111.89 -179.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -65.25 -38.22 89.66 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 122.198 -0.314 . . . . 74.040000000000006 110.524 174.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.531 ' HA ' HD12 ' A' ' 14' ' ' ILE . 21.3 tp -70.65 -32.55 69.88 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.619 0.574 . . . . 63.299999999999997 111.023 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 9' ' ' THR . 86.9 mt -61.91 -40.92 97.12 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.868 -0.605 . . . . 61.539999999999999 111.178 171.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 t -71.5 -27.55 63.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.312 0.645 . . . . 64.400000000000006 112.093 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 11' ' ' LEU . 75.6 mt -63.79 -37.5 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.395 0.678 . . . . 73.120000000000005 111.116 176.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -94.88 -87.75 0.26 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 119.584 -0.246 . . . . 74.540000000000006 110.449 175.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.421 ' HA ' HD21 ' A' ' 23' ' ' LEU . 58.2 t30 50.28 66.46 1.14 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.809 1.244 . . . . 73.319999999999993 111.798 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -85.49 -75.87 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.564 -0.744 . . . . 72.430000000000007 110.806 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -141.8 66.62 0.48 Allowed Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 111.437 -0.665 . . . . 33.119999999999997 111.437 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.68 -160.11 37.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.411 -0.424 . . . . 74.219999999999999 112.117 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.629 ' HE2' HG22 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -70.4 -29.4 66.01 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.567 0.58 . . . . 72.120000000000005 112.567 -174.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.9 mtt180 -71.5 -44.78 64.06 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 123.165 0.291 . . . . 54.399999999999999 110.434 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.69 -27.34 68.11 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 123.552 0.533 . . . . 71.129999999999995 112.828 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' A' ' 23' ' ' LEU . 1.2 mm? -71.41 -56.44 5.95 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-O 119.403 -0.332 . . . . 70.209999999999994 111.884 172.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 97.6 mtp -72.2 -35.99 69.09 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.574 0.583 . . . . 61.409999999999997 112.574 -169.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.3 -45.67 86.96 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.121 0.568 . . . . 63.32 112.202 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -78.36 -24.44 46.45 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.166 0.432 . . . . 65.430000000000007 112.166 -177.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.782 HG23 ' HB1' ' A' ' 42' ' ' ALA . 20.8 mt -67.01 -46.52 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 119.59 -0.243 . . . . 73.310000000000002 110.648 173.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -66.2 -33.73 76.43 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.501 0.556 . . . . 70.109999999999999 112.501 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.01 -36.17 59.25 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 123.458 0.473 . . . . 61.119999999999997 112.145 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.722 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.28 21.07 18.06 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.966 0.728 . . . . 74.010000000000005 112.966 -172.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HB2' ' HD3' ' A' ' 32' ' ' PRO . 79.1 mt -52.27 -53.21 55.17 Favored Pre-proline 0 CA--C 1.56 1.347 0 N-CA-C 113.402 0.889 . . . . 74.340000000000003 113.402 173.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.481 ' HD3' ' HB2' ' A' ' 31' ' ' LEU . 7.3 Cg_exo -76.33 -13.14 18.84 Favored 'Trans proline' 0 C--N 1.381 2.255 0 C-N-CA 121.982 1.788 . . . . 75.530000000000001 113.681 177.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.722 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.8 m-85 -81.49 -21.98 38.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.86 0.362 . . . . 62.520000000000003 110.742 177.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.0 mtm -84.52 163.82 19.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.863 -0.608 . . . . 63.539999999999999 110.63 171.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -85.37 177.78 7.68 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.83 -0.623 . . . . 73.109999999999999 110.518 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -42.71 -52.1 5.05 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 126.232 1.813 . . . . 75.439999999999998 114.078 -176.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -68.55 -50.59 50.71 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.301 0.64 . . . . 74.150000000000006 111.441 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 62.6 mtt -70.46 -27.43 64.23 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 124.006 0.816 . . . . 35.210000000000001 112.769 -172.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -65.84 -50.88 63.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.526 0.73 . . . . 73.430000000000007 111.12 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.16 -32.4 63.11 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.801 0.667 . . . . 72.549999999999997 112.801 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -69.17 -28.73 66.67 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.164 0.585 . . . . 75.25 110.777 178.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.782 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -66.12 -36.23 82.61 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 112.655 0.613 . . . . 64.530000000000001 112.655 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.86 -33.07 74.04 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 123.398 0.436 . . . . 74.140000000000001 111.591 176.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.423 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 79.4 mtp180 -68.32 -39.12 82.1 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.646 -0.706 . . . . 75.319999999999993 110.81 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 49' ' ' ILE . 6.9 m -73.65 -35.06 65.22 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.745 -0.661 . . . . 70.030000000000001 111.064 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 79.3 mt -62.47 -38.14 88.67 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.566 0.346 . . . . 73.200000000000003 111.534 173.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.61 -15.32 62.74 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.338 -0.847 . . . . 44.32 112.43 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 46.5 mmtm -88.36 -42.03 12.46 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.505 0.558 . . . . 62.240000000000002 112.505 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.629 HG22 ' HE2' ' A' ' 20' ' ' LYS . 6.5 mt -83.26 -25.26 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 117.838 0.29 . . . . 65.299999999999997 111.736 -172.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.1 -45.84 73.01 Favored Pre-proline 0 CA--C 1.552 1.019 0 N-CA-C 113.801 1.037 . . . . 75.310000000000002 113.801 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -76.0 -6.26 17.19 Favored 'Trans proline' 0 C--N 1.376 2.011 0 CA-C-N 122.194 1.819 . . . . 71.239999999999995 114.212 174.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.3 mt -90.96 162.38 14.77 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.033 0.444 . . . . 74.230000000000004 109.986 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.427 HG22 ' HG3' ' A' ' 56' ' ' GLU . 14.5 t -93.33 174.64 7.11 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 109.495 -0.558 . . . . 55.229999999999997 109.495 170.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.517 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 12.8 pt-20 -68.2 -26.89 65.96 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.202 0.601 . . . . 72.400000000000006 112.173 -179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -74.34 -40.53 62.11 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 122.242 0.217 . . . . 73.219999999999999 110.863 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.427 ' HG3' HG22 ' A' ' 53' ' ' THR . 48.8 mt-10 -66.67 -37.23 84.35 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.46 0.475 . . . . 52.450000000000003 112.254 -177.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -70.11 -36.26 74.71 Favored 'General case' 0 C--O 1.217 -0.653 0 O-C-N 123.299 0.374 . . . . 73.239999999999995 110.742 175.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.99 -24.99 60.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.27 0.471 . . . . 74.439999999999998 112.27 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.15 -29.99 64.58 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.364 0.265 . . . . 74.420000000000002 111.17 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.2 mt -84.86 -43.57 14.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.126 -0.488 . . . . 70.120000000000005 110.231 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.85 -110.37 0.56 Allowed 'General case' 0 C--N 1.347 0.491 0 O-C-N 125.341 1.651 . . . . 73.099999999999994 110.994 -173.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 46.6 mm -110.93 94.95 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 106.926 -1.509 . . . . 63.200000000000003 106.926 168.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -80.32 -62.59 1.63 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.33 -1.305 . . . . 73.319999999999993 111.547 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.604 ' H ' HG21 ' A' ' 9' ' ' THR . . . -126.2 86.27 2.5 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.149 0.5 . . . . 75.310000000000002 111.438 -178.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 73.040000000000006 111.109 176.893 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 C--O 1.233 0.219 0 CA-C-O 120.643 0.259 . . . . 71.510000000000005 110.65 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.01 171.38 8.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 116.068 -0.515 . . . . 64.239999999999995 110.37 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.557 ' HA ' ' HB1' ' A' ' 64' ' ' ALA . 17.0 mm -57.84 -47.15 86.86 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.627 0 C-N-CA 123.78 0.832 . . . . 72.549999999999997 111.517 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -60.21 -36.04 76.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.567 0.747 . . . . 62.240000000000002 112.64 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.576 ' HG2' HD11 ' A' ' 41' ' ' LEU . 32.7 mt-10 -75.17 -41.09 58.85 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.933 0.493 . . . . 72.150000000000006 111.495 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.424 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.8 m -76.64 -28.0 55.87 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 116.18 -0.464 . . . . 62.210000000000001 111.639 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -71.63 -26.21 62.47 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.097 0.559 . . . . 72.340000000000003 111.267 173.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.532 HD21 ' HA ' ' A' ' 42' ' ' ALA . 50.6 tp -66.21 -31.01 71.58 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 122.628 0.371 . . . . 74.049999999999997 111.204 173.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.511 HD22 HD21 ' A' ' 23' ' ' LEU . 83.7 mt -60.36 -32.5 71.34 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.248 -0.433 . . . . 33.219999999999999 111.355 173.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -69.47 -25.58 64.15 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.286 0.635 . . . . 72.200000000000003 112.329 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.9 mm -69.18 -44.96 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 122.899 0.48 . . . . 73.129999999999995 111.125 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.426 ' HB2' HD12 ' A' ' 23' ' ' LEU . 82.9 m-85 -120.23 19.29 12.2 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.982 0.734 . . . . 71.120000000000005 112.982 -172.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.517 HD22 HD11 ' A' ' 62' ' ' ILE . 31.4 t-20 -67.88 106.98 2.47 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.077 0.465 . . . . 64.230000000000004 109.999 178.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -145.07 96.38 2.84 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.894 -1.048 . . . . 75.439999999999998 108.279 -178.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.46 42.68 32.98 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 120.697 -0.763 . . . . 55.549999999999997 111.901 -173.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.52 -138.46 21.72 Favored Glycine 0 N--CA 1.447 -0.589 0 O-C-N 123.833 0.373 . . . . 63.219999999999999 112.474 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.741 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 2.2 pptp? -95.72 -7.96 35.88 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.796 0.351 . . . . 74.549999999999997 111.253 -177.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -63.92 -60.28 3.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.801 -0.636 . . . . 73.510000000000005 110.318 174.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -27.93 71.58 Favored Glycine 0 C--O 1.223 -0.579 0 CA-C-N 115.702 -0.681 . . . . 63.409999999999997 112.747 176.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.741 ' HB3' ' HA ' ' A' ' 20' ' ' LYS . 57.3 tp -59.98 -44.35 94.55 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.397 0.679 . . . . 73.329999999999998 111.406 175.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 46.5 mtt -64.16 -46.99 81.6 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.232 0.456 . . . . 42.130000000000003 112.232 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -63.79 -41.68 97.89 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 123.762 0.664 . . . . 74.219999999999999 111.339 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.415 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 20.5 m-80 -71.83 -38.05 70.23 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 112.508 0.559 . . . . 72.420000000000002 112.508 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.5 mt -70.04 -44.52 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 119.301 -0.38 . . . . 72.150000000000006 111.563 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -65.65 -35.58 81.21 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.283 0.475 . . . . 54.140000000000001 112.283 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.48 -29.99 64.13 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 123.207 0.317 . . . . 75.540000000000006 111.578 177.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.75 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -99.98 16.41 24.01 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.519 0.563 . . . . 62.439999999999998 112.519 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.2 mt -67.28 -44.81 48.9 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.618 -0.706 . . . . 53.140000000000001 112.065 172.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.8 12.61 0.69 Allowed 'Trans proline' 0 C--N 1.377 2.065 0 CA-C-N 121.759 1.664 . . . . 35.009999999999998 113.911 169.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.75 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.4 m-85 -124.47 -154.92 0.64 Allowed 'General case' 0 C--O 1.239 0.517 0 C-N-CA 123.72 0.808 . . . . 73.549999999999997 109.222 177.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 70.8 mtm 67.47 -94.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.297 1.439 . . . . 74.299999999999997 112.796 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -174.74 147.58 1.04 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.479 -1.675 . . . . 72.120000000000005 106.479 -166.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.04 -38.32 79.09 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 118.403 0.547 . . . . 72.420000000000002 112.168 -177.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.76 -45.25 75.44 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.18 0.514 . . . . 74.019999999999996 110.705 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 18.4 ttp -73.04 -24.34 60.7 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.302 -0.863 . . . . 64.209999999999994 111.844 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -69.22 -39.73 78.4 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.839 0.456 . . . . 60.539999999999999 111.626 173.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -61.72 -36.34 80.66 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.062 0.458 . . . . 75.109999999999999 111.188 173.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.576 HD11 ' HG2' ' A' ' 8' ' ' GLU . 27.2 tp -71.36 -39.06 71.49 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 115.285 -0.87 . . . . 72.310000000000002 111.04 176.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.532 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -66.41 -32.35 73.68 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.252 0.621 . . . . 70.239999999999995 112.322 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -65.39 -44.82 86.32 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.199 -0.91 . . . . 74.420000000000002 111.992 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -80.34 -22.11 41.79 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.88 0.696 . . . . 74.310000000000002 112.88 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.508 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 60.7 m -84.24 -27.29 28.03 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 120.816 0.341 . . . . 72.319999999999993 110.868 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.422 HD23 HD11 ' A' ' 49' ' ' ILE . 28.9 mt -66.99 -33.73 76.22 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 122.101 -0.375 . . . . 73.310000000000002 111.709 168.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.52 -20.53 60.63 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 123.584 0.553 . . . . 44.530000000000001 112.239 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -87.18 -25.76 23.89 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 119.484 -0.293 . . . . 63.229999999999997 111.6 178.624 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.473 HG22 HD12 ' A' ' 52' ' ' LEU . 15.4 pt -92.66 -14.76 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 112.395 0.517 . . . . 74.409999999999997 112.395 178.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.19 -48.01 97.71 Favored Pre-proline 0 CA--C 1.554 1.133 0 N-CA-C 114.639 1.348 . . . . 74.209999999999994 114.639 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.98 -1.32 11.15 Favored 'Trans proline' 0 C--N 1.38 2.215 0 CA-C-N 121.96 1.736 . . . . 62.340000000000003 113.98 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.473 HD12 HG22 ' A' ' 49' ' ' ILE . 61.4 mt -86.83 149.11 25.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.202 -0.666 . . . . 72.150000000000006 109.202 177.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 t -95.02 178.23 5.62 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 108.954 -0.758 . . . . 75.239999999999995 108.954 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -74.19 -38.79 63.53 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.746 0.308 . . . . 73.150000000000006 111.553 -172.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -72.08 -29.57 64.25 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.042 -0.526 . . . . 73.019999999999996 111.021 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -71.64 -30.94 66.31 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.208 0.603 . . . . 73.0 111.18 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -74.53 -28.22 60.87 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 110.159 -0.311 . . . . 72.519999999999996 110.159 173.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.1 -22.22 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.967 0.349 . . . . 71.049999999999997 111.7 177.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -71.23 -37.57 72.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.938 -0.574 . . . . 71.209999999999994 111.688 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.43 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 13.2 mt -85.31 -53.01 5.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.142 -0.481 . . . . 74.109999999999999 110.759 -176.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.53 -109.17 0.47 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.742 1.617 . . . . 53.229999999999997 111.136 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.517 HD11 HD22 ' A' ' 16' ' ' ASN . 47.3 mm -121.55 107.39 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 107.779 -1.193 . . . . 75.319999999999993 107.779 173.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.43 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 1.2 m-85 -97.03 -73.7 0.59 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.229 -0.441 . . . . 74.540000000000006 111.775 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.557 ' HB1' ' HA ' ' A' ' 6' ' ' ILE . . . -89.98 102.14 14.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.304 0.573 . . . . 62.409999999999997 111.111 -175.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.139 -0.937 . . . . 71.430000000000007 108.966 178.332 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.477 HD11 ' HD2' ' A' ' 48' ' ' LYS . 19.0 mt . . . . . 0 C--O 1.239 0.541 0 N-CA-C 109.166 -0.679 . . . . 52.229999999999997 109.166 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -82.64 172.6 12.76 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 109.356 -0.609 . . . . 55.200000000000003 109.356 176.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.8 mm -69.65 -22.31 25.07 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.557 -0.747 . . . . 73.219999999999999 111.01 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.31 -40.21 85.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.632 0.373 . . . . 72.400000000000006 111.689 175.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -65.91 -40.84 91.85 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.271 0.357 . . . . 74.310000000000002 111.213 175.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.492 HG21 ' H ' ' A' ' 64' ' ' ALA . 6.4 m -70.14 -34.77 73.46 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.958 -0.564 . . . . 70.510000000000005 111.467 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.485 ' O ' HG13 ' A' ' 14' ' ' ILE . 13.0 t30 -71.31 -30.82 66.69 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.659 0.784 . . . . 73.540000000000006 111.725 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.433 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 22.8 tp -62.29 -40.07 95.06 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 123.411 0.444 . . . . 74.109999999999999 111.086 176.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.401 HD13 ' HE1' ' A' ' 57' ' ' TYR . 66.1 mt -70.91 -32.47 69.41 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.336 -0.847 . . . . 73.310000000000002 111.065 177.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.0 t -70.62 -26.22 63.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.514 0.726 . . . . 75.510000000000005 112.435 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 10' ' ' ASN . 97.1 mt -61.77 -48.47 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 122.864 0.466 . . . . 54.25 111.319 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -98.0 -76.18 0.53 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.627 -0.261 . . . . 55.329999999999998 110.803 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.705 ' HA ' HD21 ' A' ' 23' ' ' LEU . 15.8 t-20 53.65 81.13 0.1 Allowed 'General case' 0 N--CA 1.474 0.739 0 O-C-N 124.925 1.391 . . . . 74.120000000000005 111.7 -177.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -102.57 -95.2 0.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.713 -0.395 . . . . 71.530000000000001 111.316 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.535 ' H ' ' HA3' ' A' ' 22' ' ' GLY . . . -118.59 82.35 0.33 Allowed Glycine 0 CA--C 1.501 -0.806 0 C-N-CA 120.561 -0.828 . . . . 62.130000000000003 111.687 -177.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.06 43.06 Favored Glycine 0 C--O 1.226 -0.379 0 N-CA-C 111.598 -0.601 . . . . 53.409999999999997 111.598 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.408 ' HD3' HG22 ' A' ' 49' ' ' ILE . 2.7 pptp? -89.15 -18.2 27.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.518 0.159 . . . . 73.25 110.939 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 mtt85 -66.39 -51.15 60.0 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 123.424 0.453 . . . . 75.430000000000007 110.35 173.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.535 ' HA3' ' H ' ' A' ' 18' ' ' GLY . . . -63.89 -29.16 74.01 Favored Glycine 0 C--N 1.339 0.731 0 O-C-N 123.966 0.791 . . . . 45.439999999999998 113.051 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.705 HD21 ' HA ' ' A' ' 16' ' ' ASN . 2.4 mm? -67.9 -51.86 43.04 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-O 118.656 -0.688 . . . . 72.349999999999994 111.275 173.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.602 ' HG2' HD22 ' A' ' 46' ' ' LEU . 52.8 mtt -63.81 -42.02 97.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.97 0.73 . . . . 63.43 112.97 -175.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -67.78 -38.09 82.93 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.305 0.483 . . . . 74.030000000000001 112.305 -177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -79.79 -33.11 40.8 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.277 0.473 . . . . 73.340000000000003 112.277 178.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.5 mt -69.22 -47.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 118.908 -0.567 . . . . 53.530000000000001 111.374 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.505 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 35.1 m-80 -66.62 -31.13 71.63 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.368 0.507 . . . . 74.219999999999999 112.368 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.45 -31.26 60.25 Favored 'General case' 0 N--CA 1.464 0.248 0 O-C-N 123.177 0.298 . . . . 74.209999999999994 111.721 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.714 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.57 18.15 22.5 Favored 'General case' 0 C--O 1.223 -0.31 0 N-CA-C 112.689 0.626 . . . . 71.230000000000004 112.689 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.505 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 52.5 mt -55.88 -49.31 93.66 Favored Pre-proline 0 CA--C 1.554 1.106 0 N-CA-C 114.121 1.156 . . . . 64.200000000000003 114.121 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -79.99 0.14 10.24 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 121.912 1.742 . . . . 62.420000000000002 113.409 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.714 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.6 m-85 -97.73 -20.83 17.33 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.197 0.199 . . . . 74.530000000000001 111.397 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.3 mtt -75.08 -81.22 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.273 0.358 . . . . 72.450000000000003 111.234 -179.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.622 ' HB3' ' HB2' ' A' ' 38' ' ' MET . 34.9 t70 -179.08 161.59 1.15 Allowed 'General case' 0 C--N 1.338 0.079 0 N-CA-C 106.812 -1.551 . . . . 64.010000000000005 106.812 -170.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.54 -47.04 85.65 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.827 0.451 . . . . 75.040000000000006 111.326 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -76.88 -34.31 57.78 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.876 -0.602 . . . . 74.109999999999999 110.447 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.622 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 3.6 tpt -72.25 -25.48 61.64 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 123.824 0.703 . . . . 65.25 111.486 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.42 ' HG3' ' HB3' ' A' ' 31' ' ' LEU . 13.0 ttp180 -70.63 -40.55 73.05 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 122.417 0.287 . . . . 74.340000000000003 110.727 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.51 -30.12 64.22 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.246 0.546 . . . . 71.209999999999994 110.587 178.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.15 -34.96 71.47 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 115.067 -0.969 . . . . 63.43 110.639 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.433 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -65.14 -40.03 93.82 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 116.164 -0.471 . . . . 65.129999999999995 111.574 175.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -68.46 -30.06 68.84 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.623 0.577 . . . . 61.0 111.553 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 tpp180 -71.07 -46.97 60.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.09 0.556 . . . . 74.099999999999994 111.552 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 49' ' ' ILE . 11.2 m -70.62 -44.04 68.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.112 -0.494 . . . . 73.129999999999995 111.302 -176.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.602 HD22 ' HG2' ' A' ' 24' ' ' MET . 52.8 mt -70.48 -27.28 64.09 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.671 0.619 . . . . 73.230000000000004 112.671 -177.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.49 -29.15 70.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.754 0.311 . . . . 72.510000000000005 111.704 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.477 ' HD2' HD11 ' A' ' 4' ' ' LEU . 14.9 tmtt? -81.53 -33.22 31.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.196 -0.457 . . . . 74.099999999999994 110.51 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.52 ' HA ' HD12 ' A' ' 52' ' ' LEU . 11.4 mt -90.8 -11.51 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-O 120.835 0.35 . . . . 70.219999999999999 111.458 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.78 -46.34 99.57 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 113.889 1.07 . . . . 74.319999999999993 113.889 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -75.66 -6.45 17.62 Favored 'Trans proline' 0 C--N 1.378 2.095 0 CA-C-N 121.76 1.664 . . . . 64.409999999999997 113.542 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.52 HD12 ' HA ' ' A' ' 49' ' ' ILE . 65.3 mt -90.11 158.22 17.39 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.603 -0.517 . . . . 61.539999999999999 109.603 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 55' ' ' ASN . 8.7 t -112.74 -167.37 1.18 Allowed 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.19 -0.67 . . . . 72.349999999999994 109.19 171.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.41 -29.16 69.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.122 0.569 . . . . 74.530000000000001 112.129 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.491 ' H ' HG23 ' A' ' 53' ' ' THR . 0.2 OUTLIER -65.0 -46.23 82.25 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.745 0.653 . . . . 74.129999999999995 110.348 177.143 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 2.4 mp0 -69.2 -28.79 66.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.996 0.739 . . . . 72.019999999999996 112.996 -178.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.401 ' HE1' HD13 ' A' ' 12' ' ' LEU . 77.9 t80 -72.45 -37.42 68.54 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 120.842 -0.343 . . . . 73.530000000000001 110.27 175.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.27 -14.04 60.48 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.436 0.532 . . . . 72.230000000000004 112.436 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 14.0 mm-40 -63.21 -31.55 72.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.084 0.469 . . . . 75.349999999999994 110.389 168.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.4 mt -89.59 -61.76 1.62 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.498 -0.774 . . . . 55.420000000000002 109.986 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.3 45.73 26.64 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 124.766 1.291 . . . . 53.119999999999997 112.495 178.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 40.9 mm 66.72 95.92 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 C-N-CA 124.796 1.238 . . . . 73.0 110.151 -174.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -85.21 -56.91 3.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.773 -1.103 . . . . 55.030000000000001 112.09 -171.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.492 ' H ' HG21 ' A' ' 9' ' ' THR . . . -114.9 -97.35 0.45 Allowed 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.934 -0.575 . . . . 73.129999999999995 111.75 -170.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.407 0 C-N-CA 126.152 1.781 . . . . 53.229999999999997 114.848 176.732 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.477 HD22 ' HZ2' ' A' ' 48' ' ' LYS . 96.6 mt . . . . . 0 CA--C 1.509 -0.604 0 CA-C-O 120.652 0.263 . . . . 73.510000000000005 110.802 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 153.13 27.16 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.778 -0.647 . . . . 35.25 109.979 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.41 -34.18 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.527 0.331 . . . . 74.319999999999993 110.865 176.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.1 -38.56 88.52 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.009 0.524 . . . . 74.409999999999997 111.4 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 36.9 mt-10 -70.42 -37.6 74.44 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 117.486 0.13 . . . . 72.439999999999998 111.31 178.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.594 ' HA ' HD12 ' A' ' 12' ' ' LEU . 5.9 m -74.81 -29.51 61.11 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 123.485 0.49 . . . . 64.319999999999993 111.369 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.465 ' O ' HG13 ' A' ' 14' ' ' ILE . 29.2 t-20 -70.92 -35.88 72.45 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.492 -0.322 . . . . 54.329999999999998 110.422 172.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.6 tp -65.95 -34.42 78.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.582 0.753 . . . . 42.450000000000003 110.882 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.78 ' HA ' HD11 ' A' ' 23' ' ' LEU . 95.6 mt -62.12 -39.99 94.38 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.514 -0.766 . . . . 62.109999999999999 110.831 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.3 t -70.41 -31.39 68.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.058 0.543 . . . . 34.409999999999997 112.27 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ASN . 77.4 mt -68.77 -45.21 81.37 Favored 'Isoleucine or valine' 0 C--N 1.347 0.463 0 CA-C-O 120.908 0.385 . . . . 75.120000000000005 110.731 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -108.33 23.62 14.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.324 0.49 . . . . 75.230000000000004 112.324 -172.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 65.9 t30 -82.41 114.36 20.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.888 0.375 . . . . 65.209999999999994 110.221 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.32 -76.27 0.6 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.48 -0.782 . . . . 73.5 109.534 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.89 61.66 0.6 Allowed Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.961 -0.856 . . . . 75.430000000000007 110.961 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.6 -149.22 21.62 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.33 -0.462 . . . . 71.349999999999994 112.348 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.516 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -78.87 -15.26 58.57 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 111.789 0.292 . . . . 74.140000000000001 111.789 -176.489 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.4 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -68.25 -46.35 70.73 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 109.153 -0.684 . . . . 61.43 109.153 172.133 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.68 -35.54 91.35 Favored Glycine 0 C--O 1.216 -0.98 0 O-C-N 124.025 0.828 . . . . 72.349999999999994 113.217 172.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.78 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.7 mm? -64.05 -46.62 83.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 117.117 0.458 . . . . 72.140000000000001 112.097 176.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 48.9 mtt -67.8 -42.43 81.62 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.952 0.352 . . . . 74.420000000000002 111.952 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 27.5 mm-40 -70.27 -44.05 69.23 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 112.319 0.488 . . . . 71.209999999999994 112.319 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -74.56 -31.3 62.05 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.47 0.544 . . . . 74.25 112.47 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 45.3 mt -72.6 -46.71 53.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 119.16 -0.448 . . . . 65.430000000000007 110.911 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -68.15 -25.26 65.18 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.693 0.627 . . . . 72.5 112.693 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.07 -26.39 36.33 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 111.469 0.174 . . . . 63.450000000000003 111.469 177.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.3 5.48 39.97 Favored 'General case' 0 C--O 1.209 -1.04 0 N-CA-C 112.689 0.625 . . . . 73.109999999999999 112.689 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 64.5 mt -60.6 -33.38 14.41 Favored Pre-proline 0 CA--C 1.56 1.351 0 N-CA-C 114.498 1.296 . . . . 74.140000000000001 114.498 176.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 31' ' ' LEU . 17.0 Cg_endo -60.46 -22.82 73.13 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.142 1.894 . . . . 75.319999999999993 114.283 166.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -105.12 -140.15 0.37 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.057 0.943 . . . . 74.540000000000006 109.181 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 86.0 mtp 73.31 160.09 0.23 Allowed 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.834 1.654 . . . . 75.239999999999995 113.194 172.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.49 148.01 47.21 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.05 -1.093 . . . . 71.25 108.05 168.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -67.23 -28.14 67.81 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 118.661 0.664 . . . . 75.239999999999995 112.159 -178.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.35 -46.09 77.97 Favored 'General case' 0 C--O 1.215 -0.757 0 O-C-N 123.481 0.488 . . . . 54.140000000000001 110.671 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.6 mmt -75.28 -28.64 59.83 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 123.833 0.708 . . . . 74.299999999999997 112.549 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -75.01 -48.96 21.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.632 0.773 . . . . 72.230000000000004 111.503 -173.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.91 -28.18 62.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.326 -0.397 . . . . 75.120000000000005 111.8 177.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.1 tp -64.97 -38.89 92.46 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.899 -0.591 . . . . 71.099999999999994 110.551 171.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.94 -28.42 68.27 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.355 1.062 . . . . 74.430000000000007 112.655 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -60.17 -39.54 86.82 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 123.671 0.607 . . . . 63.229999999999997 110.735 173.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -79.78 -30.58 40.67 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.063 -0.517 . . . . 71.0 111.336 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG12 ' A' ' 49' ' ' ILE . 73.2 m -70.45 -37.39 74.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.707 0.403 . . . . 53.219999999999999 111.189 -177.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.53 -31.9 63.92 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 111.406 0.15 . . . . 72.200000000000003 111.406 173.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.75 -31.54 71.53 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.666 0.604 . . . . 72.340000000000003 112.123 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.477 ' HZ2' HD22 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -87.31 -22.07 25.35 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.769 0.655 . . . . 61.109999999999999 112.769 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 45' ' ' THR . 35.6 pt -95.23 -12.29 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.389 0.541 . . . . 74.230000000000004 112.279 178.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.36 -44.13 87.11 Favored Pre-proline 0 CA--C 1.561 1.369 0 N-CA-C 113.828 1.047 . . . . 74.319999999999993 113.828 173.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -71.96 -10.97 26.94 Favored 'Trans proline' 0 C--N 1.38 2.207 0 CA-C-N 121.767 1.667 . . . . 54.049999999999997 113.868 170.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 86.4 mt -91.57 156.15 17.86 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.99 -0.374 . . . . 74.409999999999997 109.99 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p -92.43 -178.24 4.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.045 -0.525 . . . . 72.439999999999998 109.903 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -78.27 -25.01 46.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.35 -0.386 . . . . 74.530000000000001 111.018 175.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.87 -32.89 59.91 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 122.807 0.443 . . . . 75.310000000000002 111.799 173.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.62 -47.98 79.19 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.115 0.259 . . . . 71.430000000000007 110.641 173.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.85 -23.87 63.35 Favored 'General case' 0 C--O 1.21 -0.996 0 O-C-N 123.781 0.676 . . . . 64.0 111.931 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.8 -35.97 75.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.884 0.765 . . . . 51.210000000000001 111.616 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -82.68 -24.04 33.88 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.088 -0.506 . . . . 63.119999999999997 111.903 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.1 mt -101.66 16.01 27.13 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.239 0.615 . . . . 41.020000000000003 112.263 -175.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -82.78 97.39 8.57 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.228 -0.442 . . . . 41.200000000000003 110.446 -176.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.444 HG23 ' HB3' ' A' ' 65' ' ' ALA . 5.3 mp 58.19 78.81 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 125.157 1.536 . . . . 65.400000000000006 110.391 179.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -100.05 -23.43 14.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.832 -1.076 . . . . 74.239999999999995 111.107 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.59 ' H ' HG21 ' A' ' 9' ' ' THR . . . -148.05 80.86 1.48 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.104 0.478 . . . . 73.340000000000003 111.048 -177.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.444 ' HB3' HG23 ' A' ' 62' ' ' ILE . . . . . . . . 0 N--CA 1.465 0.304 0 CA-C-N 116.01 -0.541 . . . . 75.129999999999995 111.22 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 66.0 mt . . . . . 0 N--CA 1.451 -0.384 0 N-CA-C 109.159 -0.682 . . . . 73.409999999999997 109.159 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 34.0 p -84.73 -177.25 6.54 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.481 0.178 . . . . 71.439999999999998 111.481 -178.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.762 HD13 ' HB1' ' A' ' 64' ' ' ALA . 15.7 mm -64.26 -36.42 77.03 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.361 -0.382 . . . . 74.219999999999999 110.171 177.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -69.03 -46.35 68.15 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.742 0.417 . . . . 75.510000000000005 111.546 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.544 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 43.9 mt-10 -68.35 -43.64 77.02 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.982 0.801 . . . . 71.239999999999995 111.399 -175.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 64' ' ' ALA . 9.1 m -74.56 -29.68 61.44 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 122.659 0.384 . . . . 41.020000000000003 111.747 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -64.75 -42.56 95.08 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.6 0.36 . . . . 63.009999999999998 110.8 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.515 HD21 ' HA ' ' A' ' 42' ' ' ALA . 7.0 tp -61.83 -41.8 98.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.99 0.916 . . . . 64.430000000000007 111.606 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.808 HD22 HD21 ' A' ' 23' ' ' LEU . 65.9 mt -68.64 -31.25 70.25 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 116.204 -0.453 . . . . 73.540000000000006 111.296 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.6 t -70.53 -24.3 62.79 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.609 0.764 . . . . 72.310000000000002 111.751 176.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.0 mt -78.03 -42.4 27.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 122.53 0.332 . . . . 73.319999999999993 110.717 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -106.78 11.64 29.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.602 0.593 . . . . 62.130000000000003 112.602 -173.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -58.45 103.23 0.14 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.385 1.074 . . . . 73.239999999999995 111.761 175.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -101.6 -75.65 0.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.373 -0.83 . . . . 63.109999999999999 110.223 177.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.92 74.45 0.44 Allowed Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.416 -0.674 . . . . 71.420000000000002 111.416 -175.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.79 -136.84 19.12 Favored Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 110.874 -0.89 . . . . 64.349999999999994 110.874 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.88 -23.11 18.89 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 120.55 0.214 . . . . 75.030000000000001 110.857 173.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -74.42 -49.91 20.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.791 -0.641 . . . . 72.400000000000006 110.371 -176.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.04 -29.94 75.98 Favored Glycine 0 C--N 1.337 0.585 0 O-C-N 123.457 0.473 . . . . 74.310000000000002 112.434 172.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.808 HD21 HD22 ' A' ' 12' ' ' LEU . 63.6 tp -61.68 -43.49 98.76 Favored 'General case' 0 C--O 1.218 -0.596 0 C-N-CA 123.275 0.63 . . . . 72.129999999999995 110.949 174.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.425 ' HG2' HD13 ' A' ' 46' ' ' LEU . 55.8 mtt -70.08 -40.21 75.15 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.245 0.341 . . . . 73.409999999999997 111.81 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.75 -39.59 93.89 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.374 0.421 . . . . 74.150000000000006 111.64 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -72.86 -40.27 65.81 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 115.946 -0.57 . . . . 73.140000000000001 110.921 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.422 ' HA ' ' HE1' ' A' ' 34' ' ' MET . 32.6 mt -67.38 -46.33 83.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 119.155 -0.45 . . . . 74.209999999999994 112.192 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -67.35 -25.24 65.89 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.098 0.777 . . . . 75.420000000000002 113.098 -176.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.89 -35.42 24.13 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.476 0.176 . . . . 70.239999999999995 111.476 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.532 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.45 16.07 22.86 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 113.078 0.77 . . . . 73.329999999999998 113.078 -172.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.8 mt -53.44 -51.18 78.15 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 114.373 1.249 . . . . 72.049999999999997 114.373 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.53 -23.52 57.36 Favored 'Trans proline' 0 C--N 1.38 2.22 0 CA-C-N 121.834 1.691 . . . . 74.129999999999995 113.409 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.532 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 15.0 m-85 -92.7 10.84 28.95 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.109 0.563 . . . . 73.519999999999996 111.127 -173.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 62.8 mtt -99.17 16.29 23.28 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.009 -0.541 . . . . 73.400000000000006 111.823 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.29 -77.05 0.06 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.956 1.302 . . . . 72.129999999999995 111.976 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.65 -53.91 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.199 0.6 . . . . 50.130000000000003 109.728 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -70.48 -36.07 73.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 123.682 0.614 . . . . 71.109999999999999 112.049 -172.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 16.2 mmt -74.36 -29.57 61.62 Favored 'General case' 0 C--O 1.213 -0.82 0 O-C-N 123.363 0.415 . . . . 72.430000000000007 111.461 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -70.9 -52.5 19.7 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.45 0.3 . . . . 74.420000000000002 111.584 -177.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -66.64 -36.21 82.01 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.818 -0.628 . . . . 64.209999999999994 111.395 -176.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.456 HD11 ' HG2' ' A' ' 8' ' ' GLU . 27.7 tp -70.57 -34.81 72.62 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.8 -0.636 . . . . 54.25 111.02 177.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.515 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -66.96 -37.78 84.89 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 112.611 0.597 . . . . 61.439999999999998 112.611 -177.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -73.17 -33.59 65.52 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.004 0.19 . . . . 64.040000000000006 111.43 178.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 44' ' ' ARG . 64.3 mtt180 -67.58 -43.11 81.36 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.518 0.511 . . . . 64.450000000000003 111.324 174.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 49' ' ' ILE . 21.8 m -76.53 -30.59 57.19 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.173 -0.467 . . . . 53.409999999999997 111.274 -177.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.425 HD13 ' HG2' ' A' ' 24' ' ' MET . 12.7 mt -69.98 -30.1 67.36 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 118.724 0.693 . . . . 72.340000000000003 112.035 175.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.54 -19.31 60.94 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.362 0.414 . . . . 72.140000000000001 111.291 173.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -88.76 -24.31 22.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.009 0.523 . . . . 74.329999999999998 111.365 177.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.508 HG23 HD12 ' A' ' 52' ' ' LEU . 15.4 mt -94.09 -8.53 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.322 0.582 . . . . 75.239999999999995 109.771 175.191 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.8 -41.48 77.49 Favored Pre-proline 0 CA--C 1.557 1.243 0 CA-C-O 118.026 -0.988 . . . . 71.230000000000004 113.509 174.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.47 1.71 8.5 Favored 'Trans proline' 0 C--N 1.381 2.278 0 CA-C-N 121.677 1.635 . . . . 75.230000000000004 114.124 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.508 HD12 HG23 ' A' ' 49' ' ' ILE . 54.0 mt -96.73 169.31 9.96 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.976 -0.379 . . . . 75.349999999999994 109.976 176.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 16.9 p -105.67 -170.64 1.77 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.013 -0.54 . . . . 72.409999999999997 109.798 168.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -23.35 44.74 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.767 -0.457 . . . . 73.400000000000006 109.767 171.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -66.23 -46.3 77.68 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.798 0.839 . . . . 61.109999999999999 109.52 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 17.6 mm-40 -67.18 -29.54 69.25 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.883 0.74 . . . . 75.510000000000005 112.986 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -74.73 -36.7 62.65 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 110.43 -0.211 . . . . 75.5 110.43 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.64 -14.98 60.39 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.156 0.428 . . . . 62.100000000000001 112.156 177.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.51 -42.96 82.0 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 122.191 0.196 . . . . 74.409999999999997 111.309 172.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.532 ' HB2' ' CD1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -86.45 -44.96 11.59 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 120.939 -0.304 . . . . 73.209999999999994 111.36 178.111 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.3 34.41 22.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.292 1.437 . . . . 65.099999999999994 114.44 166.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.3 mm 67.02 93.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 122.452 1.12 . . . . 73.120000000000005 109.904 -173.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.532 ' CD1' ' HB2' ' A' ' 60' ' ' LEU . 21.6 p90 -117.35 -2.58 11.55 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.084 -1.417 . . . . 65.209999999999994 111.592 -171.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.762 ' HB1' HD13 ' A' ' 6' ' ' ILE . . . -153.82 75.31 1.03 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.09 0.471 . . . . 71.310000000000002 111.527 -173.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.397 -0.365 . . . . 64.030000000000001 111.068 177.434 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.515 HD12 ' HE1' ' A' ' 63' ' ' PHE . 58.3 mt . . . . . 0 CA--C 1.506 -0.745 0 CA-C-O 120.599 0.238 . . . . 65.430000000000007 110.623 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.411 HG22 ' HG3' ' A' ' 8' ' ' GLU . 11.5 t -82.0 166.33 19.91 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.436 -0.802 . . . . 74.439999999999998 109.448 -174.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.438 ' HA ' ' O ' ' A' ' 64' ' ' ALA . 21.9 mm -59.7 -33.06 50.85 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 O-C-N 123.663 0.602 . . . . 74.310000000000002 110.951 -177.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -70.6 -38.91 74.05 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.416 0.895 . . . . 73.310000000000002 113.416 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 48.4 mt-10 -68.17 -41.06 82.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.08 0.467 . . . . 72.510000000000005 110.889 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.685 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.7 m -74.61 -29.07 61.17 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.127 -0.942 . . . . 44.219999999999999 111.468 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -65.45 -38.81 90.95 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.399 0.68 . . . . 63.140000000000001 110.688 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.488 HD21 ' HA ' ' A' ' 42' ' ' ALA . 59.9 tp -65.34 -33.67 76.51 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.897 -0.592 . . . . 63.219999999999999 110.939 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 77.9 mt -66.07 -36.84 84.29 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.899 -0.591 . . . . 61.399999999999999 110.801 173.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 m -65.07 -23.63 67.22 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.288 0.477 . . . . 43.310000000000002 112.288 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.9 mt -85.19 -39.83 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 111.677 0.251 . . . . 54.130000000000003 111.677 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -120.24 0.81 10.72 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.804 1.409 . . . . 65.049999999999997 114.804 -166.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.484 ' HB2' HD23 ' A' ' 23' ' ' LEU . 4.3 t30 -86.65 121.78 29.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.448 0.567 . . . . 72.120000000000005 110.15 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.28 -14.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.843 -0.343 . . . . 71.439999999999998 111.873 173.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.56 61.9 0.32 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.483 -0.865 . . . . 61.340000000000003 113.573 -173.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.59 -161.53 51.49 Favored Glycine 0 C--O 1.225 -0.458 0 C-N-CA 121.442 -0.409 . . . . 63.25 113.372 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.926 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 54.5 tttt -75.06 -37.15 61.72 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 123.666 0.274 . . . . 75.409999999999997 111.432 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -65.23 -48.65 72.58 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-O 118.976 -0.535 . . . . 73.200000000000003 110.964 177.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.37 -35.92 91.72 Favored Glycine 0 C--O 1.222 -0.627 0 O-C-N 123.654 0.596 . . . . 53.329999999999998 112.858 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.484 HD23 ' HB2' ' A' ' 16' ' ' ASN . 2.4 tm? -62.02 -50.67 71.11 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.443 0.697 . . . . 65.140000000000001 110.591 176.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.893 ' HG2' HD22 ' A' ' 46' ' ' LEU . 40.7 mtt -71.66 -40.49 69.63 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 112.615 0.598 . . . . 70.099999999999994 112.615 -175.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.97 -35.43 78.36 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.294 0.372 . . . . 61.240000000000002 111.255 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -66.6 -48.61 68.97 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 123.358 0.411 . . . . 60.399999999999999 109.957 175.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.438 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 11.8 mt -61.88 -43.58 97.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 123.732 0.645 . . . . 64.129999999999995 112.255 -179.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -64.67 -36.46 84.34 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.467 0.543 . . . . 75.329999999999998 112.467 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.11 -27.47 54.05 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.547 -0.297 . . . . 55.439999999999998 111.696 178.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.531 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -102.8 15.02 30.52 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 112.864 0.69 . . . . 74.120000000000005 112.864 -175.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 79.2 mt -58.05 -47.47 98.81 Favored Pre-proline 0 CA--C 1.556 1.176 0 N-CA-C 113.681 0.993 . . . . 74.400000000000006 113.681 178.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -83.19 10.41 3.67 Favored 'Trans proline' 0 C--N 1.378 2.122 0 C-N-CA 121.849 1.699 . . . . 73.519999999999996 113.603 173.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.458 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 98.2 m-85 -109.81 -3.62 16.56 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.045 0.538 . . . . 74.420000000000002 110.217 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.1 mtt -91.7 174.39 7.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.514 -0.766 . . . . 63.210000000000001 110.877 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.66 166.55 23.38 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.99 -0.744 . . . . 71.209999999999994 108.99 163.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -73.8 -30.47 62.75 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.787 -0.571 . . . . 74.230000000000004 110.919 -178.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -72.26 -33.86 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.212 -0.449 . . . . 71.519999999999996 110.718 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.3 ttm -75.0 -27.5 60.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.724 -0.671 . . . . 71.549999999999997 110.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -75.7 -43.1 48.9 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.516 0.726 . . . . 62.350000000000001 111.923 -177.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -72.13 -29.02 63.65 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.658 -0.246 . . . . 73.140000000000001 110.994 174.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.96 -30.98 68.47 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 116.148 -0.478 . . . . 75.129999999999995 110.278 174.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.543 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -62.78 -43.32 99.11 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 123.004 0.522 . . . . 75.219999999999999 111.75 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -69.41 -33.9 73.67 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.365 0.416 . . . . 73.340000000000003 111.578 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -65.3 -42.94 92.54 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.347 -0.842 . . . . 60.32 110.727 176.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.806 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 90.6 m -74.24 -36.32 63.89 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.973 -1.012 . . . . 73.319999999999993 111.665 -178.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.893 HD22 ' HG2' ' A' ' 24' ' ' MET . 49.4 mt -69.43 -31.1 69.22 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.814 -0.553 . . . . 64.340000000000003 112.384 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.64 91.81 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.668 0.618 . . . . 65.430000000000007 112.668 -177.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.806 ' HE3' ' HA ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -88.93 -7.71 55.54 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.197 0.814 . . . . 64.140000000000001 113.197 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.453 HG22 ' HG3' ' A' ' 20' ' ' LYS . 49.8 mt -97.53 -20.83 5.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.964 0.412 . . . . 63.329999999999998 109.901 174.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -50.28 -43.69 79.09 Favored Pre-proline 0 CA--C 1.559 1.301 0 N-CA-C 115.64 1.718 . . . . 74.25 115.64 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -80.15 8.64 3.99 Favored 'Trans proline' 0 C--N 1.385 2.458 0 CA-C-N 122.289 1.853 . . . . 74.109999999999999 114.474 178.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 40.1 mt -100.48 145.73 27.92 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 110.172 -0.307 . . . . 73.109999999999999 110.172 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.5 t -98.15 29.01 3.7 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-O 121.502 0.667 . . . . 73.439999999999998 110.852 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.926 ' HG2' ' HB3' ' A' ' 20' ' ' LYS . 47.3 mt-10 83.35 -28.66 0.1 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 126.706 2.002 . . . . 72.349999999999994 112.85 172.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -72.4 -33.58 67.27 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.028 0.442 . . . . 74.409999999999997 110.931 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -76.97 -29.15 55.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.472 -0.785 . . . . 75.450000000000003 110.485 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -71.91 -29.64 64.54 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.402 -0.363 . . . . 65.019999999999996 110.848 173.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.47 80.68 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.973 0.416 . . . . 73.310000000000002 110.968 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.63 -32.2 65.72 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.921 -1.036 . . . . 54.240000000000002 111.117 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.4 mt -86.5 -82.24 0.21 Allowed 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.074 -0.343 . . . . 72.219999999999999 110.074 176.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.34 -131.06 2.14 Favored 'General case' 0 C--N 1.35 0.626 0 C-N-CA 125.224 1.41 . . . . 44.43 111.537 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.4 mp -92.66 88.19 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.495 -0.928 . . . . 61.020000000000003 108.495 178.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.515 ' HE1' HD12 ' A' ' 4' ' ' LEU . 19.0 p90 -110.04 -32.54 6.98 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.454 -0.794 . . . . 74.140000000000001 111.36 -178.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.685 ' H ' HG21 ' A' ' 9' ' ' THR . . . -133.81 64.96 1.59 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.63 0.729 . . . . 63.32 111.235 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-O 121.779 0.799 . . . . 73.409999999999997 110.259 176.778 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.9 mt . . . . . 0 CA--C 1.509 -0.613 0 N-CA-C 109.508 -0.553 . . . . 65.209999999999994 109.508 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.1 p -81.47 163.63 22.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.347 -0.541 . . . . 71.230000000000004 109.775 173.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.517 HG23 ' HB1' ' A' ' 64' ' ' ALA . 31.0 mm -67.62 -29.17 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 116.006 -0.543 . . . . 70.230000000000004 111.135 -174.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -70.86 -37.43 73.1 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.966 -0.561 . . . . 73.450000000000003 110.974 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.4 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 50.0 mt-10 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.604 0.594 . . . . 71.150000000000006 112.604 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.743 ' HB ' ' HB3' ' A' ' 64' ' ' ALA . 3.4 m -74.88 -29.32 60.97 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.738 0.304 . . . . 74.340000000000003 110.647 178.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.446 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.5 t-20 -67.61 -38.89 84.61 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.096 -0.335 . . . . 74.549999999999997 110.096 171.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.754 HD21 ' HA ' ' A' ' 42' ' ' ALA . 19.1 tp -60.71 -38.54 85.41 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.984 0.913 . . . . 72.200000000000003 111.64 175.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 89.5 mt -66.77 -32.72 74.19 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.836 -0.62 . . . . 44.5 111.423 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 t -72.0 -29.04 63.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.243 0.617 . . . . 64.25 112.081 177.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.69 HD12 ' HA ' ' A' ' 11' ' ' LEU . 71.8 mt -66.44 -42.69 90.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.119 0.568 . . . . 75.400000000000006 110.051 178.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.422 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . 75.9 m-85 -111.03 35.28 3.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.809 -0.632 . . . . 74.530000000000001 110.91 -175.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -83.31 103.7 12.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.482 0.658 . . . . 64.010000000000005 111.815 -172.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.517 ' HG2' HD22 ' A' ' 26' ' ' ASN . 4.7 pt-20 -142.3 122.2 13.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.793 -1.094 . . . . 64.439999999999998 110.122 171.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.04 -96.65 2.0 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.66 -0.7 . . . . 73.230000000000004 111.762 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.25 -131.28 1.2 Allowed Glycine 0 C--O 1.216 -0.973 0 N-CA-C 110.667 -0.973 . . . . 55.009999999999998 110.667 178.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -64.46 -46.18 84.19 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.63 0.772 . . . . 62.030000000000001 111.034 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -71.03 -47.89 56.09 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 123.372 0.42 . . . . 74.150000000000006 111.047 -175.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.65 -29.58 75.45 Favored Glycine 0 C--N 1.336 0.53 0 O-C-N 123.868 0.73 . . . . 64.540000000000006 113.531 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -43.83 98.25 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.468 0.307 . . . . 73.519999999999996 111.097 171.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.839 ' HG2' HD22 ' A' ' 46' ' ' LEU . 49.2 mtt -68.72 -38.63 80.36 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.335 0.397 . . . . 45.240000000000002 111.004 177.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.06 -44.99 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.171 0.434 . . . . 73.430000000000007 112.171 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.517 HD22 ' HG2' ' A' ' 17' ' ' GLU . 28.2 t-20 -69.48 -43.47 73.12 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.584 0.553 . . . . 60.119999999999997 110.576 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.48 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 30.9 mt -63.78 -48.19 87.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 119.12 -0.467 . . . . 71.239999999999995 111.972 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.7 -30.47 67.05 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.695 0.628 . . . . 73.209999999999994 112.695 -176.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.93 -33.72 66.12 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.033 0.208 . . . . 61.240000000000002 111.011 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.582 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -95.84 7.57 45.95 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.792 0.664 . . . . 51.240000000000002 112.792 -176.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 49.3 mt -60.93 -44.7 95.59 Favored Pre-proline 0 N--CA 1.481 1.119 0 N-CA-C 113.954 1.094 . . . . 64.329999999999998 113.954 178.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -65.35 -19.59 61.7 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.023 1.815 . . . . 72.120000000000005 114.312 174.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.582 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 20.2 m-85 -96.94 -10.49 26.25 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.713 0.292 . . . . 74.230000000000004 110.395 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.3 ttm -86.35 143.23 27.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 72.010000000000005 110.718 -171.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.42 145.56 51.29 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.851 0.719 . . . . 53.450000000000003 109.413 172.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -60.06 -30.58 69.3 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.887 1.069 . . . . 72.439999999999998 113.887 -173.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -70.06 -44.61 68.81 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.02 0.438 . . . . 64.310000000000002 110.704 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.1 ttm -74.5 -29.65 61.5 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.133 -0.939 . . . . 72.200000000000003 111.292 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.427 ' HG3' HD22 ' A' ' 31' ' ' LEU . 22.4 ttt180 -69.26 -44.89 70.99 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.736 0.814 . . . . 73.450000000000003 111.729 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.53 -33.2 70.91 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 116.305 -0.407 . . . . 73.349999999999994 111.176 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.2 tp -67.91 -40.09 83.46 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.862 -0.608 . . . . 72.439999999999998 110.431 175.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.754 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -60.92 -45.08 96.07 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.91 0.884 . . . . 60.119999999999997 113.125 -176.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -66.48 -30.16 70.44 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.469 0.481 . . . . 70.5 112.094 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 -76.6 -33.48 58.43 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 123.128 0.267 . . . . 73.129999999999995 111.532 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.3 m -71.37 -31.3 67.15 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.569 0.348 . . . . 61.520000000000003 110.505 174.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.839 HD22 ' HG2' ' A' ' 24' ' ' MET . 63.1 mt -68.61 -30.27 68.97 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 122.642 0.377 . . . . 74.439999999999998 111.379 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.12 61.35 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 123.21 0.319 . . . . 54.439999999999998 111.639 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 mttt -84.43 -37.16 21.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.701 0.401 . . . . 62.109999999999999 111.8 175.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.78 -9.31 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 112.7 0.63 . . . . 61.119999999999997 112.7 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.4 -48.96 96.42 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.911 -1.042 . . . . 65.420000000000002 113.54 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.63 -4.81 15.42 Favored 'Trans proline' 0 C--N 1.385 2.468 0 CA-C-N 121.646 1.623 . . . . 73.239999999999995 113.977 176.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 43.6 mt -89.26 145.95 25.06 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.654 -0.499 . . . . 73.140000000000001 109.654 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.485 HG23 ' H ' ' A' ' 56' ' ' GLU . 11.5 t -83.62 163.24 20.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.741 -0.663 . . . . 72.219999999999999 109.805 172.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -61.53 -39.65 91.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.019 0.928 . . . . 73.209999999999994 111.477 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.9 -35.49 76.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.834 -0.621 . . . . 74.049999999999997 112.323 -176.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.485 ' H ' HG23 ' A' ' 53' ' ' THR . 39.2 tt0 -75.87 -33.54 59.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 123.248 0.342 . . . . 72.430000000000007 111.033 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -69.89 -30.64 68.13 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.026 0.204 . . . . 71.409999999999997 111.034 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.43 -24.2 63.8 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.044 0.387 . . . . 74.5 112.044 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -76.0 -27.29 57.35 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.251 -0.431 . . . . 55.009999999999998 111.294 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.482 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.8 mt -81.53 -55.32 4.75 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.922 -0.581 . . . . 64.450000000000003 110.757 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.88 -110.3 0.55 Allowed 'General case' 0 C--N 1.348 0.503 0 O-C-N 125.114 1.509 . . . . 63.43 110.183 -168.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.427 HG23 HG22 ' A' ' 9' ' ' THR . 48.3 mm -121.47 105.43 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.111 -0.7 . . . . 63.409999999999997 109.111 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.482 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 2.7 m-85 -97.48 24.16 6.9 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.026 -0.534 . . . . 73.230000000000004 111.813 178.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.743 ' HB3' ' HB ' ' A' ' 9' ' ' THR . . . -148.96 -149.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.315 -0.402 . . . . 44.219999999999999 110.114 -177.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.225 0 C-N-CA 125.348 1.459 . . . . 55.240000000000002 112.435 178.704 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.493 HD22 ' HG2' ' A' ' 8' ' ' GLU . 76.6 mt . . . . . 0 C--O 1.238 0.464 0 N-CA-C 108.395 -0.965 . . . . 73.239999999999995 108.395 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 15.3 t -98.67 173.52 6.86 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 109.244 -0.65 . . . . 65.400000000000006 109.244 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.464 HG23 ' HB1' ' A' ' 64' ' ' ALA . 10.7 mm -60.32 -24.94 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.953 1.301 . . . . 72.239999999999995 112.192 -175.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.89 -37.79 70.09 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.724 0.809 . . . . 72.219999999999999 112.564 -178.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.522 ' HA ' HD11 ' A' ' 41' ' ' LEU . 1.3 mp0 -63.74 -43.96 94.94 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.174 0.512 . . . . 72.25 110.943 178.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.432 ' HA ' ' HG ' ' A' ' 12' ' ' LEU . 6.7 p -74.96 -25.36 58.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.659 -1.155 . . . . 54.140000000000001 112.666 178.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.469 ' O ' HG13 ' A' ' 14' ' ' ILE . 4.0 t-20 -66.52 -33.51 75.83 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.916 0.486 . . . . 55.509999999999998 111.151 174.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.432 ' HA ' HD12 ' A' ' 14' ' ' ILE . 58.7 tp -62.91 -33.96 76.42 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 122.816 0.446 . . . . 71.340000000000003 110.891 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.847 HD22 HD21 ' A' ' 23' ' ' LEU . 13.8 mt -71.46 -38.61 71.27 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.517 -0.765 . . . . 64.549999999999997 110.433 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.436 ' HB3' HG21 ' A' ' 62' ' ' ILE . 78.6 p -72.04 -22.19 61.42 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.785 0.661 . . . . 73.25 112.785 179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 10' ' ' ASN . 99.3 mt -60.88 -47.42 93.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.78 0.324 . . . . 73.310000000000002 110.218 174.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -91.91 -78.09 0.41 Allowed 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.22 -0.445 . . . . 54.32 110.947 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.6 t30 52.96 71.34 0.49 Allowed 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.727 1.267 . . . . 71.340000000000003 110.094 -172.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -140.31 123.25 16.53 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.495 -1.229 . . . . 73.219999999999999 109.818 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.34 21.24 79.46 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 115.272 0.869 . . . . 75.109999999999999 115.272 168.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.71 -140.49 29.17 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 121.294 -0.479 . . . . 53.420000000000002 112.595 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.811 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -76.8 -33.68 57.98 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 123.745 0.32 . . . . 64.319999999999993 111.307 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.502 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 38.6 mtt180 -65.28 -61.42 2.13 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 119.427 -0.321 . . . . 71.409999999999997 110.96 177.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.28 -30.82 78.71 Favored Glycine 0 C--O 1.214 -1.111 0 O-C-N 124.56 1.163 . . . . 40.399999999999999 113.924 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.847 HD21 HD22 ' A' ' 12' ' ' LEU . 26.3 tp -65.18 -48.86 71.96 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 117.317 0.558 . . . . 63.130000000000003 110.632 177.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.0 mtp -69.95 -36.79 75.55 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 123.423 0.452 . . . . 72.140000000000001 111.435 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 62.4 mm-40 -68.74 -39.86 80.12 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.269 0.355 . . . . 74.510000000000005 111.779 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -69.59 -42.77 74.0 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 119.382 -0.342 . . . . 35.219999999999999 111.397 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.421 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 40.3 mt -62.88 -43.73 99.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 O-C-N 123.784 0.677 . . . . 75.239999999999995 112.051 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.25 -39.79 95.61 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.06 0.763 . . . . 74.329999999999998 113.06 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.71 29.67 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.83 0.678 . . . . 71.519999999999996 112.83 -177.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.652 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -114.47 19.39 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.14 0.793 . . . . 63.340000000000003 113.14 -171.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 39.3 mt -51.0 -52.58 56.81 Favored Pre-proline 0 CA--C 1.552 1.049 0 N-CA-C 114.117 1.154 . . . . 71.340000000000003 114.117 174.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.48 -15.1 41.3 Favored 'Trans proline' 0 C--N 1.382 2.327 0 C-N-CA 121.777 1.651 . . . . 72.230000000000004 114.101 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.652 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 55.6 m-85 -96.58 -1.27 47.32 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.278 0.231 . . . . 74.200000000000003 111.452 -175.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 66.6 mtt -78.19 -77.82 0.15 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.941 0.4 . . . . 63.149999999999999 111.548 178.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -162.88 -90.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.107 -0.951 . . . . 62.219999999999999 109.136 -167.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 176.18 -51.92 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.765 1.226 . . . . 74.239999999999995 108.218 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -73.69 -38.08 64.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.248 -0.887 . . . . 63.109999999999999 109.366 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.427 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -62.47 -25.69 68.13 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.628 -1.169 . . . . 73.040000000000006 113.237 178.096 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -62.56 -52.6 62.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.138 0.575 . . . . 75.040000000000006 111.202 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -68.88 -36.19 77.78 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.441 0.696 . . . . 73.219999999999999 111.551 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.522 HD11 ' HA ' ' A' ' 8' ' ' GLU . 61.4 tp -59.64 -38.08 80.42 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.581 1.153 . . . . 54.0 111.807 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.29 82.66 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 124.121 0.888 . . . . 70.099999999999994 113.273 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -60.34 -40.82 92.04 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.704 0.628 . . . . 64.219999999999999 111.856 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 44' ' ' ARG . 48.0 mtm105 -76.2 -35.18 59.19 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.631 0.604 . . . . 75.129999999999995 112.631 -178.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.439 HG21 HD21 ' A' ' 12' ' ' LEU . 1.7 m -79.11 -38.6 35.78 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.597 0.221 . . . . 74.209999999999994 111.597 -176.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -66.6 -31.09 71.57 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.273 0.472 . . . . 72.530000000000001 112.273 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.81 -23.71 64.3 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.638 0.586 . . . . 74.329999999999998 111.555 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -88.56 -28.3 20.82 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.256 -0.429 . . . . 63.340000000000003 112.033 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.432 ' HA ' HD12 ' A' ' 52' ' ' LEU . 35.6 mt -93.01 -21.11 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 110.703 -0.11 . . . . 71.329999999999998 110.703 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.43 -47.58 95.75 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 114.687 1.365 . . . . 72.510000000000005 114.687 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.16 5.64 6.11 Favored 'Trans proline' 0 C--N 1.383 2.346 0 CA-C-N 121.902 1.715 . . . . 72.319999999999993 114.385 176.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 49' ' ' ILE . 96.1 mt -98.75 168.19 10.3 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.502 -0.555 . . . . 74.329999999999998 109.502 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.443 ' OG1' ' HG2' ' A' ' 56' ' ' GLU . 63.5 p -102.96 -179.81 4.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.753 -0.462 . . . . 74.409999999999997 109.753 173.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.811 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -75.11 -22.71 58.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.858 -0.61 . . . . 63.520000000000003 110.721 174.336 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -74.39 -35.77 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.442 -0.799 . . . . 75.150000000000006 110.489 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.443 ' HG2' ' OG1' ' A' ' 53' ' ' THR . 21.5 mm-40 -70.9 -39.22 72.88 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.242 -0.436 . . . . 63.130000000000003 110.876 176.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -70.05 -28.21 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.173 -0.467 . . . . 73.129999999999995 111.045 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.19 -28.55 68.19 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 111.836 0.31 . . . . 60.420000000000002 111.836 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.43 -30.23 64.42 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.459 0.303 . . . . 63.310000000000002 111.792 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.6 mt -79.01 -54.39 6.07 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.749 -0.463 . . . . 75.140000000000001 109.749 -178.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 52.21 42.93 31.0 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 125.214 1.571 . . . . 74.140000000000001 112.975 174.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.46 HG13 ' HB2' ' A' ' 12' ' ' LEU . 3.2 mp 68.98 112.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.981 0.912 . . . . 64.049999999999997 109.368 -168.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.68 -31.43 19.74 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.339 -0.846 . . . . 64.129999999999995 111.298 -171.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.464 ' HB1' HG23 ' A' ' 6' ' ' ILE . . . -154.42 128.26 8.78 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.024 0.44 . . . . 61.140000000000001 111.459 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.844 -0.616 . . . . 73.409999999999997 110.231 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.57 HD11 ' HD2' ' A' ' 48' ' ' LYS . 90.4 mt . . . . . 0 N--CA 1.449 -0.504 0 CA-C-O 120.812 0.339 . . . . 62.409999999999997 110.935 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.488 HG22 ' HG2' ' A' ' 8' ' ' GLU . 8.2 t -90.27 169.66 10.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 115.475 -0.784 . . . . 61.049999999999997 108.889 167.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.1 mm -63.38 -32.02 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.414 0.686 . . . . 74.409999999999997 112.203 -176.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -71.52 -24.28 61.93 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.57 0.581 . . . . 64.319999999999993 112.57 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.502 ' HB3' HG23 ' A' ' 45' ' ' THR . 32.5 mm-40 -63.82 -52.53 59.75 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.492 0.663 . . . . 74.120000000000005 110.307 176.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -26.4 61.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.648 -1.16 . . . . 75.409999999999997 112.25 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -66.92 -39.59 87.4 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.733 0.413 . . . . 75.200000000000003 111.152 172.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.631 HD21 ' HA ' ' A' ' 42' ' ' ALA . 27.6 tp -69.43 -37.12 77.27 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.296 0.638 . . . . 65.129999999999995 111.153 175.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.7 mt -66.11 -32.06 73.3 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.932 -0.576 . . . . 75.329999999999998 111.743 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.1 t -65.75 -32.58 74.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.798 0.687 . . . . 64.010000000000005 111.292 177.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 62.6 mt -67.08 -36.66 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 123.3 0.64 . . . . 53.240000000000002 110.854 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -116.59 28.5 8.52 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 65.319999999999993 112.303 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -83.44 95.76 8.35 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.41 -0.359 . . . . 74.299999999999997 110.948 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -166.4 136.06 3.17 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.932 -0.576 . . . . 52.530000000000001 110.007 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.38 23.68 60.34 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 115.316 0.886 . . . . 53.450000000000003 115.316 169.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 -144.5 31.33 Favored Glycine 0 C--O 1.222 -0.631 0 CA-C-N 117.216 0.508 . . . . 63.219999999999999 112.331 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -79.25 -36.92 39.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.523 0.329 . . . . 75.450000000000003 110.702 176.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -64.8 -47.84 76.61 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.321 -0.399 . . . . 75.310000000000002 110.903 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.68 -35.56 90.01 Favored Glycine 0 C--O 1.219 -0.822 0 CA-C-O 119.326 -0.708 . . . . 54.420000000000002 112.773 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.91 -47.19 83.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.939 0.495 . . . . 70.200000000000003 111.172 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.458 ' HG2' HD22 ' A' ' 46' ' ' LEU . 42.9 mtt -68.98 -35.59 76.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.792 -0.64 . . . . 71.120000000000005 112.133 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -72.57 -33.56 66.87 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.01 0.374 . . . . 74.340000000000003 112.01 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -71.03 -37.63 72.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.658 0.383 . . . . 71.409999999999997 111.383 176.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.29 -41.95 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 116.211 -0.45 . . . . 71.420000000000002 111.349 178.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -70.25 -28.97 65.66 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.92 0.711 . . . . 60.439999999999998 112.92 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.23 -28.49 62.19 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.597 0.237 . . . . 72.420000000000002 111.306 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.569 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.27 17.83 22.38 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.285 -0.416 . . . . 65.140000000000001 112.072 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.9 mt -68.33 -40.77 21.69 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-O 117.925 -1.036 . . . . 72.400000000000006 112.968 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.13 -3.0 12.46 Favored 'Trans proline' 0 C--N 1.382 2.305 0 CA-C-N 121.778 1.671 . . . . 74.129999999999995 113.885 168.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.569 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.0 m-85 -109.29 -164.01 0.91 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.201 0.6 . . . . 71.120000000000005 110.021 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.4 mtm 65.9 -169.9 0.2 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 125.035 1.334 . . . . 51.539999999999999 111.776 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -76.05 163.29 27.28 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.775 -0.648 . . . . 73.319999999999993 109.683 167.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -73.82 -24.73 59.83 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.726 -0.472 . . . . 73.019999999999996 109.726 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -66.09 -44.35 84.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.749 -0.659 . . . . 73.510000000000005 110.537 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' MET . . . . . 0.47 ' HG3' HD13 ' A' ' 11' ' ' LEU . 3.2 tpt -75.99 -25.81 56.14 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.421 -0.809 . . . . 63.350000000000001 111.205 -178.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -70.86 -44.65 65.94 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.501 1.12 . . . . 74.340000000000003 111.4 177.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -68.65 -33.38 73.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.13 -0.487 . . . . 74.209999999999994 111.566 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -66.21 -37.72 86.26 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.601 -0.727 . . . . 64.239999999999995 110.643 175.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.631 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -60.68 -37.66 82.36 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 113.571 0.952 . . . . 52.399999999999999 113.571 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -78.71 -27.44 44.94 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.133 0.271 . . . . 63.229999999999997 111.662 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -36.09 74.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.586 0.354 . . . . 75.450000000000003 111.153 172.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.502 HG23 ' HB3' ' A' ' 8' ' ' GLU . 1.6 m -81.24 -25.19 36.84 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.902 0.382 . . . . 71.209999999999994 111.583 178.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.458 HD22 ' HG2' ' A' ' 24' ' ' MET . 29.5 mt -66.58 -27.35 67.65 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.982 -0.449 . . . . 73.319999999999993 111.608 168.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.75 -18.17 64.17 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.332 0.493 . . . . 75.040000000000006 112.332 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.57 ' HD2' HD11 ' A' ' 4' ' ' LEU . 65.3 tttt -70.23 -56.48 6.69 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 110.07 -0.344 . . . . 75.219999999999999 110.07 170.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.8 mt -85.39 -20.23 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 112.833 0.679 . . . . 73.109999999999999 112.833 -163.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.87 95.88 Favored Pre-proline 0 CA--C 1.557 1.228 0 N-CA-C 114.202 1.186 . . . . 72.430000000000007 114.202 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.47 -4.28 14.04 Favored 'Trans proline' 0 C--N 1.377 2.075 0 CA-C-N 121.565 1.595 . . . . 64.049999999999997 114.161 172.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 48' ' ' LYS . 78.6 mt -85.38 133.57 34.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.433 -0.58 . . . . 74.439999999999998 109.433 176.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -89.19 24.43 2.16 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.763 0.653 . . . . 73.319999999999993 112.763 -172.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 76.64 -48.55 0.55 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 126.21 1.804 . . . . 64.019999999999996 112.732 173.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -64.48 -37.01 86.06 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.69 0.757 . . . . 70.150000000000006 109.657 170.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -68.67 -35.03 76.7 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.382 -1.281 . . . . 65.5 111.32 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -72.47 -24.9 61.25 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.919 0.487 . . . . 74.239999999999995 111.313 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -22.57 61.73 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.88 0.696 . . . . 63.340000000000003 112.88 -177.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.03 -29.48 49.42 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.837 0.351 . . . . 74.340000000000003 111.009 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.9 mt -88.89 -66.99 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.656 -0.702 . . . . 74.430000000000007 110.829 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 48.68 -105.76 0.16 Allowed 'General case' 0 CA--C 1.536 0.442 0 O-C-N 125.439 1.712 . . . . 72.439999999999998 112.304 -174.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 22.1 mm -115.41 104.31 16.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.595 -0.891 . . . . 75.010000000000005 108.595 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -110.41 -3.27 16.19 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.026 -0.534 . . . . 74.010000000000005 112.033 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -150.08 79.67 1.36 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.213 0.53 . . . . 52.32 111.63 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 121.238 0.542 . . . . 65.030000000000001 110.389 173.526 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.76 0.314 . . . . 64.540000000000006 110.288 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.2 pt -86.63 163.49 2.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 CA-C-N 115.99 -0.55 . . . . 74.400000000000006 110.524 177.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -109.33 115.1 29.35 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.322 -0.621 . . . . 73.310000000000002 109.322 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.427 ' H ' ' HZ ' ' A' ' 63' ' ' PHE . 98.4 mt -105.99 155.44 19.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.074 -0.967 . . . . 70.439999999999998 110.749 176.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 82.4 p -82.41 175.15 10.46 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.22 -0.445 . . . . 73.150000000000006 111.043 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.46 -38.37 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.303 -0.408 . . . . 73.120000000000005 110.34 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -62.72 -44.61 95.78 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 122.903 0.481 . . . . 75.310000000000002 110.989 179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.439 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 46.3 mt-10 -65.79 -51.49 58.65 Favored 'General case' 0 CA--C 1.526 0.035 0 O-C-N 124.194 0.934 . . . . 71.340000000000003 112.413 -176.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.432 HG21 ' H ' ' A' ' 64' ' ' ALA . 3.0 m -74.18 -28.51 61.32 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 123.346 0.404 . . . . 61.039999999999999 111.759 -173.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 14.9 t30 -70.89 -32.92 70.04 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.385 -0.197 . . . . 72.340000000000003 111.437 176.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.468 HD12 HD12 ' A' ' 14' ' ' ILE . 54.8 tp -70.89 -35.52 72.36 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.621 0.248 . . . . 73.129999999999995 110.859 175.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.831 HD22 HD21 ' A' ' 23' ' ' LEU . 85.4 mt -67.07 -31.81 72.56 Favored 'General case' 0 C--O 1.209 -1.054 0 CA-C-N 116.112 -0.495 . . . . 74.230000000000004 110.844 174.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.3 t -65.53 -25.3 67.39 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.841 0.857 . . . . 72.129999999999995 111.822 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.468 HD12 HD12 ' A' ' 11' ' ' LEU . 68.7 mt -72.54 -31.36 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 C-N-CA 123.213 0.605 . . . . 63.140000000000001 111.074 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.407 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . 94.7 m-85 -123.26 8.22 9.12 Favored 'General case' 0 N--CA 1.473 0.675 0 N-CA-C 113.441 0.904 . . . . 72.530000000000001 113.441 -173.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.28 106.38 1.09 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.335 0.654 . . . . 72.439999999999998 112.316 -178.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -166.18 125.2 1.57 Allowed 'General case' 0 C--O 1.222 -0.384 0 O-C-N 124.127 0.892 . . . . 73.319999999999993 109.606 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.73 38.02 24.98 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.355 -0.45 . . . . 72.420000000000002 113.129 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.33 -147.66 36.25 Favored Glycine 0 C--N 1.334 0.468 0 N-CA-C 111.688 -0.565 . . . . 61.140000000000001 111.688 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.475 ' HG3' ' OE2' ' A' ' 54' ' ' GLU . 2.9 pptp? -93.28 -18.76 22.08 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-O 120.429 0.157 . . . . 75.329999999999998 110.63 177.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.474 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 18.5 mtp85 -65.93 -57.06 8.72 Favored 'General case' 0 CA--C 1.504 -0.817 0 CA-C-N 116.032 -0.531 . . . . 74.510000000000005 110.802 174.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.6 -29.0 74.17 Favored Glycine 0 C--O 1.209 -1.436 0 O-C-N 124.028 0.83 . . . . 62.130000000000003 112.659 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.831 HD21 HD22 ' A' ' 12' ' ' LEU . 26.3 tp -62.38 -44.57 96.14 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.191 0.596 . . . . 53.520000000000003 111.47 173.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.498 ' HG2' HD22 ' A' ' 46' ' ' LEU . 62.9 mtt -69.46 -36.7 76.84 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 122.514 0.326 . . . . 61.439999999999998 111.383 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 39.8 mm-40 -73.25 -30.91 63.79 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 123.29 0.369 . . . . 54.240000000000002 111.003 179.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.407 ' HB3' ' HB3' ' A' ' 15' ' ' TYR . 2.0 m-80 -68.62 -47.77 65.8 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.154 0.582 . . . . 52.049999999999997 111.182 174.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.576 HD12 HD21 ' A' ' 46' ' ' LEU . 44.7 mt -66.05 -48.11 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 O-C-N 123.647 0.592 . . . . 71.409999999999997 111.319 -179.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.565 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 20.2 m-80 -70.61 -26.17 63.37 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.234 0.827 . . . . 75.430000000000007 113.234 -175.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.37 -28.09 41.92 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.688 0.28 . . . . 54.340000000000003 111.38 175.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.713 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -105.23 18.22 22.68 Favored 'General case' 0 C--O 1.221 -0.427 0 N-CA-C 112.18 0.437 . . . . 74.340000000000003 112.18 -176.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.801 HD22 ' HG3' ' A' ' 39' ' ' ARG . 86.6 mt -60.19 -47.51 96.58 Favored Pre-proline 0 CA--C 1.554 1.119 0 N-CA-C 113.478 0.918 . . . . 63.219999999999999 113.478 176.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.07 -14.48 35.15 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.824 1.683 . . . . 62.210000000000001 113.747 175.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.713 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 70.3 m-85 -94.98 -8.43 36.94 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.843 0.354 . . . . 73.420000000000002 110.421 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.549 ' HE3' HD23 ' A' ' 31' ' ' LEU . 6.5 ttm -93.82 164.05 13.27 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.863 -0.608 . . . . 75.030000000000001 110.333 -177.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -72.39 153.69 41.31 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 115.491 -0.777 . . . . 74.400000000000006 109.545 174.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -61.26 -41.6 97.2 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.983 0.364 . . . . 74.140000000000001 111.983 -179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -70.71 -34.78 72.3 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.867 0.365 . . . . 61.539999999999999 110.596 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 25.5 mtt -66.02 -36.52 83.49 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 115.65 -0.705 . . . . 73.239999999999995 112.328 174.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.801 ' HG3' HD22 ' A' ' 31' ' ' LEU . 48.8 ttp180 -74.49 -39.81 62.23 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 122.766 0.427 . . . . 72.340000000000003 111.661 -177.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -72.36 -29.04 63.42 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.831 0.348 . . . . 73.120000000000005 111.425 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.0 tp -72.09 -35.01 69.1 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.176 -0.466 . . . . 72.200000000000003 110.527 172.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.37 -40.74 96.43 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 112.875 0.694 . . . . 62.149999999999999 112.875 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -70.18 -26.62 63.98 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 123.242 0.339 . . . . 73.299999999999997 111.849 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 -74.57 -42.37 58.88 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 122.437 0.295 . . . . 75.329999999999998 111.657 175.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.421 HG23 ' HB3' ' A' ' 8' ' ' GLU . 5.2 m -78.79 -33.6 46.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 112.213 0.449 . . . . 73.049999999999997 112.213 -175.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.576 HD21 HD12 ' A' ' 27' ' ' ILE . 59.4 mt -69.85 -28.06 65.36 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 122.24 -0.288 . . . . 72.040000000000006 111.498 176.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.73 -17.62 62.81 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 122.564 0.346 . . . . 73.109999999999999 111.791 174.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -77.86 -32.26 51.9 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 122.471 0.308 . . . . 75.120000000000005 110.601 174.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.469 HG23 HD12 ' A' ' 52' ' ' LEU . 1.8 mt -98.94 -7.12 9.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 116.036 -0.529 . . . . 74.0 110.68 -175.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.29 -46.68 99.77 Favored Pre-proline 0 CA--C 1.552 1.047 0 CA-C-O 118.094 -0.955 . . . . 43.539999999999999 113.327 171.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.51 8.0 4.18 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.788 1.674 . . . . 72.409999999999997 114.294 172.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.469 HD12 HG23 ' A' ' 49' ' ' ILE . 78.1 mt -108.72 168.73 9.13 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.752 0.31 . . . . 72.209999999999994 110.81 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -110.37 -168.92 1.37 Allowed 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.159 -0.473 . . . . 73.109999999999999 110.602 174.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.475 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 2.9 mp0 -68.03 -29.0 67.88 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.927 0.491 . . . . 65.129999999999995 110.549 171.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.17 -45.99 71.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.435 0.694 . . . . 63.420000000000002 111.125 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -72.29 -33.58 67.52 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 112.347 0.499 . . . . 75.530000000000001 112.347 -177.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.498 ' HD1' HD12 ' A' ' 60' ' ' LEU . 53.3 t80 -75.85 -25.08 55.9 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 123.094 0.247 . . . . 74.209999999999994 110.941 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.48 -20.08 60.14 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.362 -0.211 . . . . 70.25 111.561 175.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -76.77 -32.96 58.04 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 122.423 0.289 . . . . 53.32 110.832 172.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.498 HD12 ' HD1' ' A' ' 57' ' ' TYR . 47.3 mt -70.8 -59.83 2.59 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.188 -0.671 . . . . 61.119999999999997 109.188 173.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.58 28.6 12.14 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.733 1.613 . . . . 73.099999999999994 113.832 171.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 33.1 mm 62.04 89.92 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.238 0.493 0 C-N-CA 124.562 1.145 . . . . 70.450000000000003 110.77 -171.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.427 ' HZ ' ' H ' ' A' ' 4' ' ' LEU . 24.1 p90 -97.03 -39.35 9.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 114.713 -1.131 . . . . 72.430000000000007 110.532 177.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.432 ' H ' HG21 ' A' ' 9' ' ' THR . . . -105.9 76.44 1.18 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.255 0.55 . . . . 42.240000000000002 112.364 -173.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -151.69 10.62 0.56 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.166 -0.925 . . . . 50.229999999999997 110.13 172.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -98.41 -17.91 18.56 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.705 0.764 . . . . 74.209999999999994 109.964 -176.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 49.7 mp0 -78.16 -23.28 47.77 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.816 -1.084 . . . . 61.530000000000001 111.414 -175.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.5 m -93.03 -0.6 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 112.161 0.43 . . . . 65.150000000000006 112.161 -178.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 81.7 mt -77.38 -23.8 50.68 Favored 'General case' 0 C--O 1.224 -0.273 0 N-CA-C 111.935 0.346 . . . . 63.409999999999997 111.935 -176.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -78.26 -7.65 57.44 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.47 0.544 . . . . 70.030000000000001 112.47 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -83.31 -33.41 25.93 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.784 0.434 . . . . 72.150000000000006 111.678 -174.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -133.6 -46.96 0.81 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 110.293 -0.262 . . . . 65.349999999999994 110.293 -177.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 69.52 95.58 0.07 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.285 1.434 . . . . 62.450000000000003 111.305 -170.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -82.06 123.55 29.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.799 -1.092 . . . . 63.439999999999998 108.055 171.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -68.47 110.13 4.02 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.808 0.693 . . . . 55.210000000000001 111.637 -173.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 114.48 -1.236 . . . . 74.0 109.968 -175.776 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.4 ttm . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 109.312 -0.625 . . . . 73.340000000000003 109.312 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.3 tt -78.49 142.34 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 115.837 -0.62 . . . . 75.200000000000003 111.496 -177.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.43 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 26.8 mmt180 -83.62 98.85 9.83 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.451 -0.795 . . . . 75.030000000000001 111.304 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.8 mt -109.27 140.41 42.94 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.131 -0.94 . . . . 62.109999999999999 109.513 174.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 41.2 p -82.57 174.63 10.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.379 -0.373 . . . . 73.430000000000007 111.093 178.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 42.1 mm -62.68 -34.47 65.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 123.932 0.77 . . . . 73.540000000000006 111.181 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -74.18 -33.43 63.46 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 122.749 0.419 . . . . 65.109999999999999 111.884 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 49.6 mt-10 -73.78 -37.99 64.81 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.471 -0.331 . . . . 64.109999999999999 111.181 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.7 p -74.29 -27.21 60.63 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.049 -0.523 . . . . 61.340000000000003 112.088 174.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.467 ' O ' HG12 ' A' ' 14' ' ' ILE . 23.9 t-20 -67.77 -37.56 82.25 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 122.935 0.494 . . . . 74.209999999999994 110.914 172.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.458 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 17.7 tp -63.4 -37.9 89.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.449 0.7 . . . . 65.120000000000005 111.228 175.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 57.4 mt -68.28 -35.99 78.69 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.404 -0.816 . . . . 63.130000000000003 110.595 174.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.0 t -70.22 -24.22 63.06 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.975 0.91 . . . . 55.340000000000003 112.303 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 10' ' ' ASN . 40.6 mm -61.14 -45.26 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 123.023 0.529 . . . . 73.349999999999994 110.049 175.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -104.64 -76.0 0.61 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.72 -0.673 . . . . 75.530000000000001 111.171 -172.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 65.1 t30 53.4 76.16 0.22 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.257 1.423 . . . . 54.240000000000002 112.284 -179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -153.51 128.74 9.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.208 -0.906 . . . . 54.549999999999997 110.216 -177.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 66.92 37.68 92.35 Favored Glycine 0 C--N 1.339 0.728 0 O-C-N 124.057 0.848 . . . . 64.329999999999998 114.44 172.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.54 -143.94 37.91 Favored Glycine 0 C--N 1.335 0.527 0 N-CA-C 111.947 -0.461 . . . . 73.129999999999995 111.947 -176.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.512 ' HB2' HD12 ' A' ' 49' ' ' ILE . 1.2 pptp? -92.77 -14.84 27.32 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.554 -0.535 . . . . 61.32 109.554 178.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.5 ttm180 -67.92 -52.64 33.92 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.051 -0.977 . . . . 65.030000000000001 110.081 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.77 -27.92 73.49 Favored Glycine 0 CA--C 1.522 0.496 0 CA-C-N 115.269 -0.878 . . . . 50.43 112.75 174.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.492 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -60.02 -42.77 95.07 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 116.845 0.323 . . . . 63.140000000000001 110.937 172.189 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.868 ' HG2' HD22 ' A' ' 46' ' ' LEU . 51.9 mtt -68.92 -37.55 79.0 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 123.252 0.345 . . . . 64.540000000000006 111.711 178.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -67.05 -39.88 87.01 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.559 0.537 . . . . 74.200000000000003 111.742 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -76.33 -32.88 58.94 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 112.306 0.484 . . . . 75.299999999999997 112.306 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 31.7 mt -71.36 -44.99 71.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-O 119.271 -0.395 . . . . 73.510000000000005 111.29 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.478 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 21.2 m-80 -67.65 -33.84 75.75 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.262 0.467 . . . . 75.400000000000006 112.262 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.8 -31.64 64.99 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.256 0.348 . . . . 74.219999999999999 111.523 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.752 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.35 20.26 19.17 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 112.907 0.706 . . . . 72.120000000000005 112.907 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.478 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 80.0 mt -55.9 -47.68 98.25 Favored Pre-proline 0 CA--C 1.555 1.139 0 N-CA-C 113.286 0.847 . . . . 71.540000000000006 113.286 175.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -83.55 3.6 7.6 Favored 'Trans proline' 0 C--N 1.379 2.133 0 CA-C-N 121.164 1.451 . . . . 72.129999999999995 114.245 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.752 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.7 m-85 -103.41 -29.6 11.1 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.705 0.288 . . . . 73.030000000000001 110.765 -178.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.3 ptp -81.9 170.63 15.41 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.885 -0.783 . . . . 60.109999999999999 108.885 169.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -68.09 155.11 40.26 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 123.205 0.316 . . . . 64.519999999999996 110.451 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -68.03 -32.75 73.34 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 111.99 0.367 . . . . 73.030000000000001 111.99 -177.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.79 -36.09 72.87 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.184 0.516 . . . . 65.439999999999998 111.091 175.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 6.5 tpt -72.52 -26.96 61.96 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.956 -1.02 . . . . 72.030000000000001 110.881 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -73.38 -39.33 65.2 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 124.237 1.015 . . . . 73.430000000000007 111.371 178.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.18 -35.29 79.35 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.475 -0.33 . . . . 62.310000000000002 111.188 176.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.5 tp -69.61 -40.17 76.76 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.646 -0.706 . . . . 65.439999999999998 110.82 173.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.571 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -58.86 -45.24 90.58 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 124.078 0.951 . . . . 62.100000000000001 113.47 -175.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -67.37 -28.97 68.39 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 123.569 0.543 . . . . 74.319999999999993 111.828 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.476 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 78.5 mtp180 -78.95 -33.77 44.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.355 -0.384 . . . . 70.109999999999999 111.544 178.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.426 ' O ' HG12 ' A' ' 49' ' ' ILE . 17.7 m -73.82 -27.24 61.01 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 122.781 0.433 . . . . 75.209999999999994 110.46 175.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.868 HD22 ' HG2' ' A' ' 24' ' ' MET . 38.8 mt -68.72 -30.81 69.53 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 111.406 0.15 . . . . 75.450000000000003 111.406 172.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.87 -20.15 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-O 120.852 0.358 . . . . 72.430000000000007 111.407 173.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.476 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 74.3 mmtt -78.33 -48.51 15.45 Favored 'General case' 0 N--CA 1.457 -0.119 0 CA-C-N 115.938 -0.573 . . . . 75.310000000000002 110.261 177.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.512 HD12 ' HB2' ' A' ' 20' ' ' LYS . 16.0 pt -81.97 -13.3 12.4 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 N-CA-C 113.21 0.818 . . . . 53.229999999999997 113.21 -176.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -43.06 -48.36 14.85 Favored Pre-proline 0 N--CA 1.486 1.36 0 N-CA-C 116.338 1.977 . . . . 71.530000000000001 116.338 177.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -82.59 27.62 0.6 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 CA-C-N 122.301 1.857 . . . . 73.219999999999999 115.386 176.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.9 mt -102.11 143.55 31.8 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.78 0.8 . . . . 74.209999999999994 111.887 177.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.615 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 22.7 m -101.62 26.31 7.49 Favored 'General case' 0 CA--C 1.56 1.363 0 CA-C-N 114.023 -1.444 . . . . 70.230000000000004 110.854 -174.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 77.86 -51.26 0.51 Allowed 'General case' 0 N--CA 1.5 2.068 0 C-N-CA 125.995 1.718 . . . . 74.010000000000005 112.652 173.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -70.11 -31.27 68.75 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.701 0.8 . . . . 53.240000000000002 110.986 -178.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.615 ' OE1' ' HB ' ' A' ' 53' ' ' THR . 26.4 mp0 -67.53 -35.52 79.25 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.898 -0.592 . . . . 72.230000000000004 111.011 174.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -75.04 -27.25 59.97 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-N 115.807 -0.633 . . . . 75.400000000000006 110.335 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.07 -22.73 60.54 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 117.877 0.308 . . . . 73.109999999999999 111.461 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -79.17 -31.21 43.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.957 0.503 . . . . 73.530000000000001 111.634 175.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 69.7 mt -89.14 -51.66 5.47 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.565 -0.289 . . . . 63.149999999999999 110.586 -178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.68 -121.71 1.83 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.226 1.81 . . . . 73.439999999999998 111.878 178.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 24.3 mm -95.88 100.48 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.401 -1.333 . . . . 65.219999999999999 107.401 174.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -92.06 -26.32 18.37 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.677 -0.692 . . . . 75.510000000000005 112.112 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -139.77 88.07 2.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.536 0.684 . . . . 42.200000000000003 111.872 -179.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -122.97 16.93 10.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.51 0.671 . . . . 74.239999999999995 110.51 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -85.13 -32.06 22.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.595 -0.729 . . . . 60.119999999999997 111.092 179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -93.29 1.19 57.1 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.927 0.343 . . . . 73.219999999999999 111.927 -177.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.9 m -86.57 -34.5 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 109.86 -0.422 . . . . 75.019999999999996 109.86 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.5 mt -92.69 113.63 25.96 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 107.932 -1.136 . . . . 73.430000000000007 107.932 174.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 71.64 156.84 0.17 Allowed 'General case' 0 N--CA 1.479 0.978 0 O-C-N 125.694 1.871 . . . . 75.349999999999994 109.679 -163.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 44.2 m170 78.12 -46.27 0.44 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 125.334 1.454 . . . . 63.420000000000002 113.14 177.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -105.47 -8.97 17.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.476 0.179 . . . . 74.450000000000003 110.794 173.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -104.09 96.92 6.98 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 109.671 -0.492 . . . . 73.319999999999993 109.671 178.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -160.02 151.55 19.83 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.391 -0.822 . . . . 71.5 109.638 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 -90.4 164.51 14.28 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.601 -0.272 . . . . 64.439999999999998 110.719 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.351 -0.386 . . . . 75.230000000000004 110.25 -177.26 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.555 ' HG3' HD22 ' A' ' 60' ' ' LEU . 13.7 tmm? . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 108.821 -0.807 . . . . 71.140000000000001 108.821 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.719 HG22 ' H ' ' A' ' 3' ' ' ARG . 7.4 mt 57.12 -155.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.275 0 O-C-N 124.708 1.255 . . . . 73.310000000000002 108.699 -173.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.719 ' H ' HG22 ' A' ' 2' ' ' ILE . 5.3 mpt_? -111.21 31.58 5.97 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 120.806 -1.184 . . . . 75.430000000000007 109.642 169.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.448 HD22 HG23 ' A' ' 45' ' ' THR . 74.8 mt -70.02 126.37 29.49 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 114.683 -1.144 . . . . 63.409999999999997 110.142 175.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.2 166.97 20.9 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.227 -0.897 . . . . 73.439999999999998 109.848 -177.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.482 HG22 HG13 ' A' ' 68' ' ' VAL . 31.5 mm -67.94 -24.13 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.17 0.588 . . . . 65.299999999999997 111.982 -174.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -73.23 -34.42 65.88 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.862 -0.608 . . . . 62.009999999999998 110.676 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 40.6 mt-10 -73.51 -37.14 65.76 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 123.454 0.471 . . . . 71.239999999999995 111.357 -178.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.2 p -73.21 -27.66 61.74 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.496 0.498 . . . . 71.430000000000007 111.687 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.445 ' O ' HG12 ' A' ' 14' ' ' ILE . 9.0 t-20 -64.48 -40.07 94.98 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.003 0.521 . . . . 61.049999999999997 111.046 171.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.582 HD21 ' HA ' ' A' ' 42' ' ' ALA . 16.7 tp -60.7 -34.34 74.22 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.067 0.947 . . . . 73.319999999999993 111.561 175.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.722 HD22 HD21 ' A' ' 23' ' ' LEU . 40.0 mt -71.07 -35.81 72.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.627 -0.715 . . . . 71.239999999999995 110.572 178.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.594 ' HA ' HD12 ' A' ' 62' ' ' ILE . 17.1 t -71.23 -23.75 62.06 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.32 -0.854 . . . . 74.109999999999999 112.902 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 10' ' ' ASN . 27.8 mm -61.87 -45.78 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.883 0.473 . . . . 72.420000000000002 110.142 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -106.33 -84.16 0.51 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 118.612 -0.709 . . . . 73.120000000000005 111.265 -174.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.473 ' H ' HD13 ' A' ' 23' ' ' LEU . 65.0 t30 46.58 87.02 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.238 1.415 . . . . 74.430000000000007 112.894 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -93.17 -83.98 0.3 Allowed 'General case' 0 CA--C 1.535 0.37 0 O-C-N 122.027 -0.421 . . . . 73.319999999999993 110.575 -179.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -120.13 83.81 0.36 Allowed Glycine 0 N--CA 1.439 -1.143 0 N-CA-C 109.987 -1.245 . . . . 73.430000000000007 109.987 177.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.07 -134.94 20.67 Favored Glycine 0 N--CA 1.449 -0.46 0 O-C-N 124.395 0.703 . . . . 44.310000000000002 111.422 -176.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 3.0 pptp? -97.91 -22.03 16.56 Favored 'General case' 0 C--O 1.215 -0.717 0 O-C-N 123.8 0.353 . . . . 74.299999999999997 111.157 178.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.471 ' HB2' ' OE1' ' A' ' 54' ' ' GLU . 53.3 ttp180 -70.23 -51.04 33.77 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 123.568 0.543 . . . . 72.150000000000006 110.33 -178.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.33 -29.18 71.95 Favored Glycine 0 C--O 1.223 -0.571 0 O-C-N 124.183 0.927 . . . . 42.32 112.592 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.722 HD21 HD22 ' A' ' 12' ' ' LEU . 26.8 tp -63.14 -41.86 99.38 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.264 0.625 . . . . 71.430000000000007 110.97 172.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.779 ' HG2' HD22 ' A' ' 46' ' ' LEU . 58.0 mtt -67.42 -37.91 83.77 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 122.979 0.512 . . . . 64.319999999999993 111.64 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 49.0 mm-40 -67.09 -37.8 84.58 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 123.411 0.445 . . . . 74.420000000000002 110.978 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -71.27 -33.89 70.19 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 112.388 0.514 . . . . 65.409999999999997 112.388 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.9 mt -71.56 -46.56 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 123.183 0.302 . . . . 43.229999999999997 111.049 176.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.409 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 22.2 m-80 -71.95 -31.23 66.11 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 113.053 0.761 . . . . 65.25 113.053 -176.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.87 -30.37 50.8 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.541 0.2 . . . . 72.430000000000007 111.541 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.753 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.68 18.42 19.35 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.448 0.536 . . . . 35.399999999999999 112.448 -178.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 71.9 mt -57.81 -46.34 99.74 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 113.521 0.934 . . . . 63.219999999999999 113.521 171.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -67.96 -18.26 46.47 Favored 'Trans proline' 0 C--N 1.383 2.353 0 CA-C-N 121.666 1.631 . . . . 73.400000000000006 113.399 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.753 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 90.7 m-85 -90.44 -32.78 16.25 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 122.376 0.27 . . . . 74.209999999999994 111.574 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptp -81.6 168.9 17.69 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.608 0.242 . . . . 61.009999999999998 110.761 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -78.55 171.81 14.57 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.961 -0.563 . . . . 64.25 112.029 -177.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -36.85 85.44 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.57 -0.741 . . . . 64.519999999999996 112.936 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -73.22 -35.84 66.37 Favored 'General case' 0 N--CA 1.462 0.139 0 O-C-N 123.394 0.434 . . . . 73.140000000000001 110.753 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 50.6 ttm -73.99 -30.48 62.5 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.45 0.469 . . . . 74.329999999999998 111.065 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.4 mtm-85 -68.8 -41.56 78.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 111.766 0.284 . . . . 74.230000000000004 111.766 174.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.09 -47.68 85.2 Favored 'General case' 0 CA--C 1.517 -0.324 0 O-C-N 123.838 0.711 . . . . 65.340000000000003 111.065 175.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.5 tp -61.49 -41.93 98.02 Favored 'General case' 0 C--N 1.33 -0.264 0 O-C-N 124.568 1.168 . . . . 65.299999999999997 111.58 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.582 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -55.73 -43.91 77.04 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 124.514 1.134 . . . . 74.409999999999997 113.468 -177.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -64.12 -36.16 83.13 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 123.888 0.742 . . . . 61.420000000000002 112.441 -176.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -80.12 -34.86 37.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.406 -0.361 . . . . 64.140000000000001 111.964 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.448 HG23 HD22 ' A' ' 4' ' ' LEU . 13.7 m -72.28 -39.93 67.98 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.645 0.378 . . . . 65.430000000000007 111.618 -179.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.779 HD22 ' HG2' ' A' ' 24' ' ' MET . 63.9 mt -65.93 -29.0 69.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.194 0.442 . . . . 74.420000000000002 112.194 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.13 -23.02 63.92 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 123.508 0.505 . . . . 41.030000000000001 112.189 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -87.49 -27.82 22.42 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 122.43 0.292 . . . . 71.230000000000004 111.665 -178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.56 HG23 HD12 ' A' ' 52' ' ' LEU . 9.9 mt -98.11 -12.39 8.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 121.144 0.497 . . . . 73.120000000000005 110.691 -176.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -54.55 -46.01 99.31 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 114.456 1.28 . . . . 60.509999999999998 114.456 173.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.99 -12.56 26.04 Favored 'Trans proline' 0 C--N 1.385 2.486 0 CA-C-N 121.863 1.701 . . . . 74.340000000000003 114.414 174.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.601 HD11 HD11 ' A' ' 2' ' ' ILE . 72.6 mt -83.46 139.32 33.01 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 109.625 -0.509 . . . . 75.109999999999999 109.625 -176.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 56' ' ' GLU . 11.4 t -82.8 168.41 17.18 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 120.857 -0.337 . . . . 75.230000000000004 110.252 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 4.9 tp10 -64.13 -40.34 95.96 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.931 0.892 . . . . 74.409999999999997 111.404 -174.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -74.59 -29.73 61.43 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.862 -0.608 . . . . 70.430000000000007 111.597 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.405 ' H ' HG23 ' A' ' 53' ' ' THR . 51.5 tt0 -72.11 -36.25 69.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.224 -0.443 . . . . 72.430000000000007 111.324 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -74.33 -23.16 59.01 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.318 -0.401 . . . . 70.310000000000002 110.744 176.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.71 -24.71 67.05 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 111.964 0.357 . . . . 72.25 111.964 174.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -76.17 -25.86 55.64 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 122.93 0.492 . . . . 75.319999999999993 111.588 175.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.555 HD22 ' HG3' ' A' ' 1' ' ' MET . 29.6 mt -93.29 -53.56 4.05 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.258 -0.428 . . . . 74.430000000000007 110.42 -175.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 63.92 -85.03 0.02 OUTLIER 'General case' 0 C--N 1.351 0.645 0 C-N-CA 126.477 1.911 . . . . 70.129999999999995 112.603 179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.594 HD12 ' HA ' ' A' ' 13' ' ' SER . 49.5 mm -120.12 -44.79 2.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 108.838 -0.801 . . . . 74.409999999999997 108.838 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 72.12 -79.83 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.117 1.767 . . . . 74.510000000000005 112.669 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.08 69.22 1.48 Allowed 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 121.202 0.525 . . . . 72.239999999999995 112.147 -172.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -119.11 -5.34 10.5 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.304 0.574 . . . . 62.399999999999999 111.237 176.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -84.37 1.14 46.53 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.746 -0.661 . . . . 65.530000000000001 111.036 177.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -88.89 -29.25 19.76 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.114 -0.494 . . . . 72.400000000000006 111.846 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 HG22 ' A' ' 6' ' ' ILE . 5.7 m -87.07 -31.68 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-O 119.304 -0.379 . . . . 63.149999999999999 111.276 175.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.5 mt 64.71 -83.73 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.045 1.338 . . . . 74.209999999999994 112.071 -179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -109.02 136.46 48.51 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-O 121.109 0.48 . . . . 63.100000000000001 110.242 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -134.66 -20.33 1.79 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.363 -0.835 . . . . 71.129999999999995 110.829 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -135.4 17.22 3.39 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 120.748 -0.381 . . . . 75.230000000000004 111.946 -172.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.7 t60 74.83 -54.5 0.66 Allowed 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 125.698 1.599 . . . . 73.530000000000001 113.145 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 22.4 m80 68.13 168.98 0.27 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 125.457 1.503 . . . . 75.430000000000007 112.933 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -134.23 99.48 4.41 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.332 -0.988 . . . . 74.140000000000001 108.332 175.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 . . . . . 0 N--CA 1.479 1.015 0 O-C-N 124.863 1.352 . . . . 75.239999999999995 110.76 -175.571 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 ptm . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.801 0.334 . . . . 73.0 110.679 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.0 tt -89.45 149.45 4.02 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.898 -0.778 . . . . 63.020000000000003 108.898 176.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -100.53 102.14 13.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.68 0.753 . . . . 73.510000000000005 109.553 176.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.3 mt -78.97 149.67 32.21 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 114.3 -1.318 . . . . 75.040000000000006 109.22 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 14.8 t -72.82 156.09 39.26 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.905 -0.776 . . . . 70.040000000000006 108.905 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.613 HD13 ' HB2' ' A' ' 67' ' ' GLU . 48.0 mt -62.39 -27.26 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 123.853 0.861 . . . . 64.540000000000006 111.505 -173.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -73.12 -35.07 66.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.909 0.483 . . . . 63.049999999999997 111.877 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -73.18 -35.42 66.39 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 122.262 0.225 . . . . 34.409999999999997 110.977 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.611 HG21 ' H ' ' A' ' 64' ' ' ALA . 5.7 m -73.5 -28.95 62.18 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 123.852 0.72 . . . . 64.319999999999993 110.596 178.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.747 ' HB2' HG21 ' A' ' 68' ' ' VAL . 55.0 t30 -66.15 -39.69 90.0 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.904 -0.589 . . . . 71.409999999999997 110.879 170.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.465 HD13 ' HG3' ' A' ' 38' ' ' MET . 62.8 tp -67.05 -34.3 77.37 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.838 0.455 . . . . 70.239999999999995 111.064 177.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.635 HD13 ' HE1' ' A' ' 57' ' ' TYR . 72.4 mt -67.97 -32.86 73.57 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.585 -0.734 . . . . 73.340000000000003 111.088 174.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -72.01 -37.28 69.82 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.485 0.714 . . . . 74.510000000000005 112.484 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 90.3 mt -69.07 -45.48 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-O 120.968 0.414 . . . . 63.399999999999999 110.808 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -102.02 28.08 6.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.125 -0.489 . . . . 72.439999999999998 111.545 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.428 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 12.9 t-20 -73.27 100.3 3.1 Favored 'General case' 0 C--N 1.344 0.339 0 O-C-N 123.606 0.567 . . . . 75.219999999999999 110.247 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -113.84 -69.25 0.87 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.344 -0.844 . . . . 71.329999999999998 111.479 -174.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -146.56 64.0 0.44 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.893 -0.67 . . . . 34.130000000000003 111.869 -175.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.19 -157.41 40.85 Favored Glycine 0 C--O 1.225 -0.42 0 C-N-CA 121.443 -0.408 . . . . 51.32 112.1 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -69.53 -33.9 73.47 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 122.595 0.358 . . . . 72.219999999999999 111.495 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.497 ' HD3' ' HA ' ' A' ' 21' ' ' ARG . 12.3 mmt180 -73.45 -43.46 60.25 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-O 118.803 -0.618 . . . . 65.219999999999999 112.133 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.82 -27.72 71.58 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 120.982 -0.628 . . . . 54.130000000000003 112.905 174.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.596 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.3 mm? -67.56 -54.49 19.47 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 122.843 0.457 . . . . 72.219999999999999 111.27 170.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.765 ' HG2' HD22 ' A' ' 46' ' ' LEU . 30.8 mtt -64.45 -44.46 91.02 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.014 0.746 . . . . 73.310000000000002 113.014 -174.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 18.1 mm-40 -68.9 -36.6 78.22 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 122.71 0.404 . . . . 63.32 111.795 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -70.91 -46.28 62.8 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 109.955 -0.387 . . . . 75.430000000000007 109.955 177.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.424 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 34.5 mt -62.29 -41.96 93.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.32 0.648 . . . . 74.549999999999997 112.338 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.14 -42.82 95.69 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.308 0.643 . . . . 71.219999999999999 112.183 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -27.34 36.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 72.349999999999994 112.073 -177.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.751 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -97.48 11.39 36.95 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 113.173 0.805 . . . . 74.310000000000002 113.173 -174.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 55.4 mt -57.9 -45.88 99.76 Favored Pre-proline 0 CA--C 1.557 1.215 0 N-CA-C 114.458 1.281 . . . . 73.0 114.458 177.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.3 -12.21 31.47 Favored 'Trans proline' 0 C--N 1.384 2.401 0 C-N-CA 121.815 1.677 . . . . 75.310000000000002 113.999 173.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.751 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 74.3 m-85 -96.77 -7.84 32.75 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.36 0.264 . . . . 75.510000000000005 111.24 -178.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.3 mtt -83.05 154.91 24.18 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.317 0.58 . . . . 73.349999999999994 111.846 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -71.74 158.93 35.23 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 114.386 -1.279 . . . . 43.450000000000003 109.048 171.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -47.69 -38.94 16.16 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.753 1.221 . . . . 74.319999999999993 113.819 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.18 -51.69 42.87 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 123.352 0.407 . . . . 64.239999999999995 111.697 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.465 ' HG3' HD13 ' A' ' 11' ' ' LEU . 0.5 OUTLIER -73.74 -28.23 61.58 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.867 0.691 . . . . 74.0 112.867 -173.672 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -68.03 -55.72 11.55 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 123.686 0.794 . . . . 75.299999999999997 111.566 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -70.73 -29.23 65.44 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.855 0.687 . . . . 71.319999999999993 112.855 178.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.2 tp -63.8 -38.91 92.86 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 123.734 0.646 . . . . 75.420000000000002 110.7 176.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.473 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -60.86 -37.05 80.76 Favored 'General case' 0 C--O 1.215 -0.726 0 N-CA-C 113.711 1.004 . . . . 75.209999999999994 113.711 -175.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.62 -37.12 86.47 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.39 0.431 . . . . 51.109999999999999 110.743 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -80.07 -31.75 39.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.666 -0.697 . . . . 75.25 111.327 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.1 m -69.66 -43.11 73.24 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 122.856 0.463 . . . . 53.210000000000001 110.355 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.765 HD22 ' HG2' ' A' ' 24' ' ' MET . 85.9 mt -68.75 -29.39 67.78 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.654 -0.703 . . . . 72.310000000000002 111.731 178.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.79 -24.15 61.69 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 123.438 0.461 . . . . 73.409999999999997 111.474 177.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -87.52 -33.03 19.1 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.347 0.499 . . . . 72.409999999999997 112.347 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 34.8 pt -90.92 -13.93 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 112.894 0.702 . . . . 52.310000000000002 112.894 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -49.78 91.9 Favored Pre-proline 0 N--CA 1.48 1.067 0 CA-C-O 117.797 -1.097 . . . . 64.549999999999997 113.619 176.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -73.87 -10.73 23.37 Favored 'Trans proline' 0 C--N 1.384 2.435 0 C-N-CA 121.708 1.605 . . . . 75.439999999999998 113.213 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 ' HG2' ' A' ' 56' ' ' GLU . 78.0 mt -81.55 148.5 29.11 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 109.667 -0.494 . . . . 73.200000000000003 109.667 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.526 HG23 ' H ' ' A' ' 56' ' ' GLU . 7.1 t -77.95 167.52 21.35 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.399 -0.593 . . . . 65.200000000000003 109.399 170.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -66.79 -31.76 72.6 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.886 0.474 . . . . 74.409999999999997 110.415 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -73.31 -29.71 62.88 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.36 -0.837 . . . . 74.129999999999995 111.008 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.547 ' HG2' HD22 ' A' ' 52' ' ' LEU . 4.9 tp10 -66.73 -46.42 75.53 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.861 0.464 . . . . 74.209999999999994 109.793 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.635 ' HE1' HD13 ' A' ' 12' ' ' LEU . 76.0 t80 -67.36 -29.09 68.54 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 123.774 0.671 . . . . 62.450000000000003 111.552 177.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.64 -33.45 72.8 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.422 0.527 . . . . 52.340000000000003 112.422 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -80.51 -29.5 37.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.319 -0.4 . . . . 75.420000000000002 111.514 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.0 mt -104.01 16.7 25.7 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.705 0.631 . . . . 64.129999999999995 112.705 -171.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.75 -69.97 0.1 Allowed 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 62.299999999999997 113.294 -169.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.3 mp -121.68 89.55 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 N-CA-C 107.227 -1.398 . . . . 71.400000000000006 107.227 169.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -90.02 -64.98 1.06 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 113.997 -1.456 . . . . 64.049999999999997 109.945 -178.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.611 ' H ' HG21 ' A' ' 9' ' ' THR . . . -121.35 96.34 5.05 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.37 -0.377 . . . . 75.319999999999993 110.853 -179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -131.69 6.18 4.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.904 0.383 . . . . 73.0 110.546 175.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.93 -35.77 62.16 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.686 -0.688 . . . . 54.210000000000001 111.5 -176.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.613 ' HB2' HD13 ' A' ' 6' ' ' ILE . 40.3 mt-10 -92.42 11.54 25.8 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.248 -0.887 . . . . 54.420000000000002 112.356 -170.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.747 HG21 ' HB2' ' A' ' 10' ' ' ASN . 3.3 m -119.24 2.88 7.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 116.322 -0.399 . . . . 62.229999999999997 110.823 169.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 98.4 mt -77.79 154.1 32.23 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.539 -0.541 . . . . 74.040000000000006 109.539 174.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.5 tt0 71.57 9.74 6.4 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 124.898 1.374 . . . . 62.450000000000003 111.401 -174.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -85.83 73.95 10.27 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-O 122.411 1.1 . . . . 70.040000000000006 108.951 175.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -146.92 -30.63 0.35 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 113.575 -1.648 . . . . 73.340000000000003 107.825 -178.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 24.0 p-80 -75.06 135.16 41.23 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 109.1 -0.704 . . . . 73.310000000000002 109.1 175.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 54.97 69.0 0.78 Allowed 'General case' 0 N--CA 1.476 0.843 0 O-C-N 124.681 1.238 . . . . 63.219999999999999 112.118 -177.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -87.32 103.87 15.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.415 -0.811 . . . . 74.209999999999994 109.594 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 . . . . . 0 C--O 1.236 0.361 0 CA-C-N 115.286 -0.87 . . . . 73.409999999999997 109.998 -178.706 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.542 ' HG3' HD11 ' A' ' 60' ' ' LEU . 50.0 ttm . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 109.893 -0.41 . . . . 75.349999999999994 109.893 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.537 HG23 HD21 ' A' ' 52' ' ' LEU . 19.5 pt -91.88 163.1 2.32 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-O 121.055 0.455 . . . . 72.040000000000006 111.687 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.39 115.66 30.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.038 -1.097 . . . . 74.420000000000002 108.038 174.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.3 mt -110.69 155.72 22.03 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.736 -0.665 . . . . 73.430000000000007 110.694 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.1 t -88.56 170.69 10.65 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 109.014 -0.736 . . . . 70.230000000000004 109.014 173.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -66.79 -30.97 51.44 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 123.039 0.535 . . . . 72.329999999999998 111.185 -172.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.406 ' O ' HD21 ' A' ' 41' ' ' LEU . 1.9 mp0 -62.74 -49.82 73.52 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.252 0.621 . . . . 65.230000000000004 111.708 177.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -66.06 -39.27 89.95 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.429 0.691 . . . . 75.109999999999999 111.864 -175.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.401 ' HA ' HD12 ' A' ' 12' ' ' LEU . 3.8 p -74.63 -26.34 59.82 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.855 0.687 . . . . 71.120000000000005 112.855 178.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -67.76 -32.48 73.11 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.052 0.541 . . . . 64.310000000000002 110.919 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.477 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 16.6 tp -64.55 -39.58 94.01 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.409 0.684 . . . . 52.509999999999998 111.048 172.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 9' ' ' THR . 55.4 mt -69.53 -32.14 70.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.381 -0.827 . . . . 74.400000000000006 111.037 178.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.529 ' HA ' HD12 ' A' ' 62' ' ' ILE . 22.6 t -69.37 -24.85 63.93 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.935 0.894 . . . . 51.420000000000002 111.867 178.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.8 mt -67.19 -44.27 87.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 122.691 0.396 . . . . 72.150000000000006 110.341 174.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.449 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 95.5 m-85 -95.98 -86.84 0.3 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.313 0.486 . . . . 75.299999999999997 112.313 -175.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.551 ' HA ' HD21 ' A' ' 23' ' ' LEU . 13.4 t-20 53.87 85.32 0.05 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.905 1.282 . . . . 64.049999999999997 112.041 -171.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -88.82 -81.87 0.26 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.182 -0.463 . . . . 74.409999999999997 111.104 -177.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -163.52 53.6 0.29 Allowed Glycine 0 CA--C 1.499 -0.937 0 N-CA-C 110.5 -1.04 . . . . 73.099999999999994 110.5 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 113.83 -175.28 16.24 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 110.729 -0.948 . . . . 65.519999999999996 110.729 -175.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.458 ' HD3' HG22 ' A' ' 49' ' ' ILE . 3.0 pptp? -83.92 -18.54 37.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.696 0.248 . . . . 71.129999999999995 111.565 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.53 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 22.5 ttm180 -65.25 -52.18 56.09 Favored 'General case' 0 C--O 1.218 -0.56 0 O-C-N 123.824 0.702 . . . . 73.450000000000003 109.319 172.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.76 -29.6 75.46 Favored Glycine 0 N--CA 1.449 -0.467 0 O-C-N 124.516 1.135 . . . . 54.539999999999999 113.378 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.3 mm? -64.07 -42.31 97.02 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 116.901 0.351 . . . . 53.240000000000002 110.925 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.657 ' HG2' HD22 ' A' ' 46' ' ' LEU . 64.0 mtt -69.07 -41.19 77.89 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.848 0.314 . . . . 74.230000000000004 111.848 178.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 7.5 mm-40 -65.01 -36.24 83.76 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.61 0.243 . . . . 74.299999999999997 111.48 179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.449 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.9 m-80 -78.85 -44.1 23.66 Favored 'General case' 0 C--O 1.222 -0.345 0 N-CA-C 112.56 0.578 . . . . 72.349999999999994 112.56 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.419 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 52.6 mt -64.55 -51.34 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 CA-C-O 119.17 -0.443 . . . . 71.209999999999994 111.837 -178.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -62.41 -37.52 86.11 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.145 0.794 . . . . 62.409999999999997 113.145 -175.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.69 -30.13 27.02 Favored 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.491 0.552 . . . . 72.430000000000007 112.491 -176.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.528 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -104.47 19.54 20.12 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.229 0.455 . . . . 71.439999999999998 112.229 -175.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 89.5 mt -55.05 -45.36 99.85 Favored Pre-proline 0 CA--C 1.559 1.292 0 N-CA-C 113.629 0.974 . . . . 62.409999999999997 113.629 168.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -67.89 -13.55 38.79 Favored 'Trans proline' 0 C--N 1.394 2.952 0 C-N-CA 122.063 1.842 . . . . 74.230000000000004 114.094 174.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.528 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.9 m-85 -92.03 -10.44 39.19 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 120.517 0.198 . . . . 75.340000000000003 111.158 178.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 64.0 mtm -99.95 -177.97 3.71 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.34 0.59 . . . . 71.329999999999998 111.902 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.37 159.86 28.12 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.03 -0.987 . . . . 74.430000000000007 110.23 177.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.57 -36.59 83.02 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.203 0.601 . . . . 52.399999999999999 111.596 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -70.45 -35.93 73.64 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.078 0.466 . . . . 65.209999999999994 110.254 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -25.98 61.33 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.456 -0.793 . . . . 53.32 111.839 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 -68.82 -41.83 78.07 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.117 0.567 . . . . 55.109999999999999 110.838 177.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -73.04 -31.74 64.63 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.324 -0.398 . . . . 74.239999999999995 111.652 178.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.406 HD21 ' O ' ' A' ' 7' ' ' GLU . 42.9 tp -68.17 -34.66 76.71 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.046 -0.525 . . . . 74.540000000000006 111.062 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.477 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -59.0 -41.37 87.49 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 123.625 0.77 . . . . 61.109999999999999 112.566 179.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -66.47 -35.26 79.83 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 123.828 0.705 . . . . 74.430000000000007 111.493 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -69.88 -42.82 72.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.963 -0.562 . . . . 72.319999999999993 111.447 178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.0 m -72.53 -36.75 68.38 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 123.684 0.615 . . . . 73.219999999999999 111.195 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.657 HD22 ' HG2' ' A' ' 24' ' ' MET . 82.5 mt -67.37 -28.32 67.85 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.196 0.443 . . . . 64.409999999999997 112.196 177.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.0 -22.9 61.35 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.762 0.315 . . . . 73.030000000000001 111.534 175.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.1 mmtt -83.7 -32.91 25.3 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 122.963 0.505 . . . . 71.219999999999999 111.315 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.712 HG23 HD12 ' A' ' 52' ' ' LEU . 7.3 mt -94.54 -10.86 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 CA-C-O 121.245 0.545 . . . . 73.140000000000001 110.797 -177.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.65 -45.77 99.91 Favored Pre-proline 0 CA--C 1.557 1.223 0 N-CA-C 114.509 1.3 . . . . 61.399999999999999 114.509 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -77.63 -1.88 12.04 Favored 'Trans proline' 0 C--N 1.388 2.61 0 CA-C-N 121.854 1.698 . . . . 72.129999999999995 113.605 174.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.712 HD12 HG23 ' A' ' 49' ' ' ILE . 57.7 mt -86.56 140.79 29.55 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.061 -0.718 . . . . 61.310000000000002 109.061 174.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 3.0 t -84.22 170.37 13.81 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 108.521 -0.918 . . . . 65.010000000000005 108.521 168.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.464 ' OE1' ' HB2' ' A' ' 21' ' ' ARG . 15.0 tp10 -61.58 -41.24 97.13 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.687 0.795 . . . . 64.129999999999995 112.88 -166.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t30 -75.29 -28.2 59.64 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.216 -0.902 . . . . 75.540000000000006 112.497 -173.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.65 -52.18 66.63 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.573 0.546 . . . . 71.340000000000003 112.273 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -69.12 -24.75 64.15 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.624 0.578 . . . . 71.129999999999995 111.841 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.4 -29.45 70.51 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 111.798 0.296 . . . . 71.040000000000006 111.798 178.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -81.99 -15.03 55.1 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.589 0.589 . . . . 74.310000000000002 112.589 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.542 HD11 ' HG3' ' A' ' 1' ' ' MET . 4.6 mp -84.35 -52.21 6.37 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.363 -0.21 . . . . 73.420000000000002 110.675 175.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 57.66 -101.05 0.12 Allowed 'General case' 0 C--N 1.354 0.796 0 O-C-N 125.168 1.542 . . . . 62.240000000000002 111.457 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.529 HD12 ' HA ' ' A' ' 13' ' ' SER . 40.1 mm -113.89 90.94 1.61 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 107.635 -1.246 . . . . 63.130000000000003 107.635 169.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -96.28 105.27 17.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 108.916 -0.772 . . . . 72.25 108.916 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 70.66 -166.13 0.15 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 125.4 1.48 . . . . 72.340000000000003 109.995 -166.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.405 ' O ' HG22 ' A' ' 68' ' ' VAL . . . 78.28 -22.45 0.28 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 126.121 1.768 . . . . 55.340000000000003 114.866 173.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -74.52 -16.42 60.83 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 117.999 0.363 . . . . 75.420000000000002 111.593 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -74.64 -11.7 60.25 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 123.368 0.667 . . . . 74.540000000000006 112.155 -176.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 65' ' ' ALA . 14.8 m -78.11 -24.47 13.93 Favored 'Isoleucine or valine' 0 C--N 1.348 0.519 0 CA-C-N 117.989 0.359 . . . . 61.130000000000003 110.8 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 44.9 mt -73.87 -19.42 60.72 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.24 0.543 . . . . 72.219999999999999 110.523 179.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -94.87 -34.15 12.55 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.348 -0.842 . . . . 75.420000000000002 110.003 174.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -71.79 -49.04 42.3 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.073 -0.512 . . . . 74.120000000000005 111.903 -172.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -102.52 -23.42 13.9 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 120.664 -0.414 . . . . 53.509999999999998 111.697 178.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m80 60.58 -90.8 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.674 1.19 . . . . 73.319999999999993 110.844 -170.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -141.68 154.35 45.27 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.333 -1.358 . . . . 71.430000000000007 107.333 169.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -87.24 87.78 7.52 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.419 0.628 . . . . 74.310000000000002 109.76 174.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.5 t-160 . . . . . 0 C--O 1.234 0.28 0 CA-C-N 114.537 -1.211 . . . . 62.539999999999999 108.803 179.123 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.41 ' HG3' HD21 ' A' ' 60' ' ' LEU . 24.3 ttt . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 109.883 -0.414 . . . . 64.400000000000006 109.883 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.553 HG21 HD11 ' A' ' 52' ' ' LEU . 18.4 tt -90.66 145.92 6.83 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 CA-C-O 121.149 0.5 . . . . 75.230000000000004 109.842 174.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -99.21 105.94 18.04 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.787 -0.642 . . . . 75.510000000000005 110.131 177.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 70.9 mt -108.65 150.59 27.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.53 -0.759 . . . . 63.350000000000001 110.256 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.9 t -84.3 170.24 13.87 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 109.602 -0.518 . . . . 74.329999999999998 109.602 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.63 -33.71 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.656 0.782 . . . . 71.409999999999997 111.014 -174.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -73.41 -34.82 65.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 112.259 0.466 . . . . 73.340000000000003 112.259 -179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 53.8 mt-10 -70.15 -39.59 75.28 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.419 0.155 . . . . 62.310000000000002 111.419 178.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.504 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.5 m -73.91 -28.03 61.33 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 123.562 0.539 . . . . 72.239999999999995 110.815 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -65.62 -41.61 92.51 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.949 0.5 . . . . 74.329999999999998 110.334 174.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' A' ' 42' ' ' ALA . 51.4 tp -68.15 -34.6 76.64 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.244 -0.889 . . . . 73.549999999999997 111.256 177.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 91.5 mt -65.1 -36.02 82.96 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 115.656 -0.702 . . . . 70.109999999999999 111.656 175.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 43.1 m -65.62 -28.28 69.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 123.811 0.694 . . . . 75.310000000000002 112.148 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.411 HD12 ' HA ' ' A' ' 11' ' ' LEU . 55.4 mt -71.39 -37.78 66.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.003 0.521 . . . . 72.409999999999997 110.945 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -119.11 27.33 8.91 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.742 0.275 . . . . 72.409999999999997 111.742 -174.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.527 ' HA ' HD21 ' A' ' 23' ' ' LEU . 9.7 t30 -76.94 101.21 5.87 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.058 -0.519 . . . . 53.240000000000002 111.736 -172.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.458 ' HG3' HD21 ' A' ' 26' ' ' ASN . 26.8 mm-40 -118.66 -117.88 0.32 Allowed 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.488 -0.778 . . . . 75.109999999999999 112.249 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -96.64 87.83 0.96 Allowed Glycine 0 C--N 1.341 0.84 0 C-N-CA 121.325 -0.464 . . . . 43.219999999999999 112.985 -169.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.28 -150.91 46.16 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 111.645 -0.582 . . . . 51.210000000000001 111.645 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.644 ' HG2' ' HB3' ' A' ' 54' ' ' GLU . 4.7 pttp -85.38 -17.39 36.86 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.751 -0.38 . . . . 72.239999999999995 110.431 175.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -67.45 -48.84 66.07 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.894 -0.593 . . . . 71.129999999999995 109.942 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.35 -33.08 86.29 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 123.89 0.744 . . . . 72.349999999999994 113.342 175.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.527 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.9 mm? -64.8 -51.78 60.38 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.9 0.35 . . . . 73.510000000000005 111.894 176.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.5 mtp -70.77 -34.6 71.98 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.457 0.473 . . . . 74.230000000000004 111.648 -173.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -66.45 -43.85 84.42 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 111.974 0.361 . . . . 74.129999999999995 111.974 175.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.458 HD21 ' HG3' ' A' ' 17' ' ' GLU . 79.1 m-20 -69.4 -40.87 77.08 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 112.523 0.564 . . . . 74.109999999999999 112.523 -178.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.496 ' CG2' ' HB1' ' A' ' 42' ' ' ALA . 63.8 mt -65.89 -44.75 92.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 119.149 -0.453 . . . . 51.310000000000002 111.426 -177.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.427 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 49.2 m-80 -70.12 -25.78 63.65 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.562 0.579 . . . . 70.319999999999993 112.562 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.86 -27.97 33.23 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 111.655 0.243 . . . . 74.099999999999994 111.655 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -98.28 7.65 45.93 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.934 0.346 . . . . 73.439999999999998 111.934 -178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.427 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 89.2 mt -58.55 -45.38 99.67 Favored Pre-proline 0 CA--C 1.549 0.906 0 CA-C-O 118.3 -0.857 . . . . 71.129999999999995 112.955 173.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -64.0 -5.77 9.89 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 122.567 2.178 . . . . 53.420000000000002 114.598 173.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -108.23 -134.56 0.34 Allowed 'General case' 0 C--O 1.242 0.665 0 N-CA-C 108.172 -1.047 . . . . 63.130000000000003 108.172 177.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 63.0 mtt 61.11 -105.44 0.2 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.784 1.234 . . . . 62.439999999999998 110.875 179.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -159.19 -69.08 0.08 Allowed 'General case' 0 C--N 1.341 0.209 0 C-N-CA 123.933 0.893 . . . . 71.409999999999997 109.355 172.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 176.01 -40.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.478 1.511 . . . . 71.310000000000002 108.507 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.22 -50.39 63.96 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.864 -1.062 . . . . 54.520000000000003 110.222 176.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 42.9 mtp -64.37 -27.9 69.33 Favored 'General case' 0 C--O 1.209 -1.066 0 O-C-N 123.839 0.712 . . . . 73.519999999999996 112.212 175.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -73.73 -49.76 24.04 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.448 0.468 . . . . 73.109999999999999 111.705 -176.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -72.47 -32.0 65.88 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 111.85 0.315 . . . . 73.420000000000002 111.85 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.4 tp -69.12 -33.62 73.76 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.087 -0.506 . . . . 51.119999999999997 110.7 174.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.496 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -66.37 -31.67 72.58 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-N 116.006 -0.543 . . . . 63.200000000000003 112.084 179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -70.38 -31.49 68.75 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.623 0.577 . . . . 75.019999999999996 111.381 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 44' ' ' ARG . 43.8 mtt180 -71.05 -38.69 72.53 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.284 0.365 . . . . 75.409999999999997 111.55 173.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.487 ' O ' HG13 ' A' ' 49' ' ' ILE . 13.8 m -73.56 -33.92 64.92 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 123.537 0.523 . . . . 70.450000000000003 111.227 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 90.1 mt -67.09 -31.92 72.73 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 122.547 0.339 . . . . 71.319999999999993 111.638 174.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.52 -20.34 62.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 123.582 0.551 . . . . 71.349999999999994 111.635 174.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 0.2 OUTLIER -81.22 -40.66 23.48 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.621 -0.263 . . . . 70.420000000000002 111.091 176.67 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.493 ' HA ' HD12 ' A' ' 52' ' ' LEU . 2.0 mt -89.73 -15.86 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 112.215 0.45 . . . . 71.430000000000007 112.215 -172.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.79 -47.51 98.57 Favored Pre-proline 0 CA--C 1.555 1.17 0 N-CA-C 114.13 1.159 . . . . 71.140000000000001 114.13 174.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.21 0.97 9.32 Favored 'Trans proline' 0 C--N 1.378 2.107 0 CA-C-N 121.855 1.698 . . . . 42.5 113.789 174.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.553 HD11 HG21 ' A' ' 2' ' ' ILE . 88.0 mt -87.23 158.08 19.18 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-O 121.033 0.444 . . . . 45.399999999999999 110.367 176.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.624 HG23 ' H ' ' A' ' 56' ' ' GLU . 7.5 t -102.02 158.49 16.11 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.748 -0.834 . . . . 73.010000000000005 108.748 169.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.644 ' HB3' ' HG2' ' A' ' 20' ' ' LYS . 4.8 pt-20 -87.2 -4.4 59.1 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 120.719 0.295 . . . . 74.319999999999993 111.064 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.04 -45.44 70.44 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.563 -0.744 . . . . 55.119999999999997 109.516 166.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.624 ' H ' HG23 ' A' ' 53' ' ' THR . 29.8 tt0 -76.93 -34.35 57.67 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 115.889 -0.596 . . . . 74.150000000000006 110.854 177.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.417 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 54.9 t80 -67.4 -25.08 65.77 Favored 'General case' 0 C--O 1.215 -0.759 0 O-C-N 123.271 0.357 . . . . 72.329999999999998 110.998 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.05 -37.99 81.97 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.094 -0.379 . . . . 64.239999999999995 111.246 174.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -79.87 -19.94 47.08 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.386 0.513 . . . . 71.209999999999994 112.386 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.41 HD21 ' HG3' ' A' ' 1' ' ' MET . 83.3 mt -84.06 -68.23 0.73 Allowed 'General case' 0 C--O 1.234 0.258 0 N-CA-C 109.854 -0.424 . . . . 73.530000000000001 109.854 173.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.82 -127.7 2.36 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 125.525 1.53 . . . . 64.230000000000004 111.452 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 39.4 mm -99.34 95.34 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 107.974 -1.121 . . . . 63.140000000000001 107.974 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -106.34 -7.44 17.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.278 -0.874 . . . . 75.299999999999997 111.303 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.504 ' H ' HG21 ' A' ' 9' ' ' THR . . . -137.12 -172.84 3.3 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.677 -0.861 . . . . 72.450000000000003 108.677 178.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 67.45 18.93 10.09 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.854 1.262 . . . . 51.0 111.802 -175.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -92.14 -14.77 28.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.673 -0.694 . . . . 71.400000000000006 110.591 177.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -90.52 -14.63 32.26 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.695 -0.684 . . . . 71.299999999999997 111.521 -178.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.6 m -89.49 -5.35 10.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 116.588 -0.278 . . . . 40.100000000000001 111.411 -175.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.9 mt -68.98 117.02 10.12 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.865 -0.607 . . . . 73.430000000000007 110.771 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 75.26 -11.38 1.1 Allowed 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 125.663 1.585 . . . . 75.310000000000002 113.765 177.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -73.55 -36.39 65.64 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 118.335 0.516 . . . . 74.439999999999998 109.906 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -121.51 123.93 43.2 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.722 -0.844 . . . . 54.530000000000001 108.722 167.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -95.26 118.24 31.69 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.055 -0.521 . . . . 74.129999999999995 110.404 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.2 t60 -138.79 128.44 24.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.851 -0.613 . . . . 65.420000000000002 109.583 -178.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -75.12 146.63 41.22 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.912 -0.585 . . . . 55.420000000000002 111.323 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.7 m80 . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.398 -0.819 . . . . 74.140000000000001 111.159 -176.183 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.3 tpp . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.953 0.406 . . . . 74.150000000000006 110.83 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.7 HG12 HD11 ' A' ' 52' ' ' LEU . 18.6 pt -129.42 -178.15 2.35 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 115.829 -0.623 . . . . 72.439999999999998 109.471 173.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -117.22 114.41 23.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.604 0.716 . . . . 74.209999999999994 111.574 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 5.1 mp -95.0 152.06 18.64 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.723 -1.214 . . . . 63.409999999999997 107.723 167.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.703 HG22 ' HG3' ' A' ' 8' ' ' GLU . 4.2 t -76.14 171.54 14.33 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 109.472 -0.566 . . . . 73.219999999999999 109.472 179.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.853 HG22 HG13 ' A' ' 68' ' ' VAL . 9.1 mm -61.78 -36.67 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 123.142 0.577 . . . . 74.439999999999998 111.859 -170.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.02 -24.9 59.62 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.172 0.805 . . . . 72.420000000000002 113.172 176.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.703 ' HG3' HG22 ' A' ' 5' ' ' THR . 46.7 mt-10 -75.42 -38.78 59.62 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 117.762 0.256 . . . . 61.299999999999997 111.053 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.12 -28.68 62.4 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.464 0.478 . . . . 74.299999999999997 111.871 174.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.832 ' HB2' HG11 ' A' ' 68' ' ' VAL . 14.5 t-20 -62.46 -46.08 90.14 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.472 0.482 . . . . 71.230000000000004 110.652 170.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.466 ' HA ' HD12 ' A' ' 14' ' ' ILE . 49.2 tp -64.74 -33.6 76.35 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 124.028 0.83 . . . . 74.400000000000006 111.646 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.595 ' HA ' HD11 ' A' ' 23' ' ' LEU . 81.1 mt -59.59 -47.74 84.38 Favored 'General case' 0 C--O 1.214 -0.812 0 O-C-N 124.032 0.833 . . . . 62.340000000000003 111.731 175.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 46.2 p -71.55 -23.2 61.72 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.711 0.634 . . . . 71.239999999999995 112.711 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.466 HD12 ' HA ' ' A' ' 11' ' ' LEU . 87.9 mt -64.73 -51.52 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 122.766 0.426 . . . . 72.5 111.278 175.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.551 ' HB2' HD13 ' A' ' 23' ' ' LEU . 68.9 m-85 -106.3 29.8 6.51 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 112.057 0.392 . . . . 73.25 112.057 -174.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.44 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 14.7 t-20 -84.09 102.45 12.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.247 -0.433 . . . . 63.539999999999999 111.415 -176.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -123.22 -26.7 4.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.855 -0.611 . . . . 73.120000000000005 111.74 173.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -168.12 69.5 0.17 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.698 -0.763 . . . . 64.519999999999996 112.055 -175.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 70.83 -149.28 46.12 Favored Glycine 0 N--CA 1.45 -0.372 0 O-C-N 123.859 0.388 . . . . 52.009999999999998 112.439 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.854 ' HE3' ' HA ' ' A' ' 53' ' ' THR . 0.6 OUTLIER -90.4 -11.17 41.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.741 0.305 . . . . 64.219999999999999 110.436 178.824 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -65.5 -52.86 49.7 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 123.963 0.905 . . . . 73.120000000000005 109.283 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.8 -30.34 74.4 Favored Glycine 0 C--O 1.218 -0.888 0 CA-C-N 114.966 -1.015 . . . . 41.5 112.622 174.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.716 ' HB2' ' HA ' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -62.28 -46.95 86.47 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 117.15 0.475 . . . . 63.109999999999999 111.353 175.32 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.614 ' HG2' HD22 ' A' ' 46' ' ' LEU . 46.3 mtt -63.72 -43.77 95.56 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.242 0.617 . . . . 74.340000000000003 112.369 -177.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -74.11 -36.0 64.19 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 123.584 0.553 . . . . 75.329999999999998 112.02 -176.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -74.54 -33.67 62.79 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 119.534 -0.27 . . . . 64.019999999999996 111.52 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.488 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 11.9 mt -66.6 -49.73 72.46 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 CA-C-O 119.282 -0.39 . . . . 71.040000000000006 111.17 176.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -65.27 -35.59 81.5 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.436 0.532 . . . . 74.439999999999998 112.436 -177.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.62 -34.53 58.35 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 111.971 0.359 . . . . 60.119999999999997 111.971 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.732 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -100.11 17.34 21.39 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 112.676 0.621 . . . . 75.010000000000005 112.676 -176.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 70.3 mt -57.83 -44.44 99.41 Favored Pre-proline 0 CA--C 1.554 1.134 0 N-CA-C 113.673 0.99 . . . . 73.310000000000002 113.673 172.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -69.61 -15.97 37.93 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 121.931 1.754 . . . . 55.310000000000002 113.787 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.732 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 99.4 m-85 -92.03 -9.95 40.94 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.566 0.346 . . . . 72.219999999999999 111.616 -178.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.533 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 65.7 mtt -85.28 162.77 18.98 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.294 0.569 . . . . 65.430000000000007 111.309 179.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -75.89 149.98 37.67 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 107.064 -1.458 . . . . 74.109999999999999 107.064 160.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -60.63 -25.13 66.07 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.081 0.771 . . . . 75.299999999999997 113.081 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -66.46 -48.53 69.63 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.69 0.618 . . . . 75.109999999999999 111.095 177.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 31.8 ttp -77.42 -24.29 50.44 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 115.501 -0.772 . . . . 75.510000000000005 111.155 -179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.437 ' HA ' ' SD ' ' A' ' 34' ' ' MET . 57.4 ttt180 -63.52 -53.03 58.3 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.78 1.232 . . . . 75.129999999999995 111.878 178.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -73.52 -26.72 61.0 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 122.696 0.398 . . . . 71.329999999999998 112.059 174.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.4 tp -61.94 -39.0 90.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 122.524 0.33 . . . . 70.030000000000001 110.707 172.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.402 ' HB1' ' CG2' ' A' ' 27' ' ' ILE . . . -66.3 -30.18 70.54 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 124.187 0.995 . . . . 50.399999999999999 112.329 177.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.469 ' HA ' ' HD3' ' A' ' 43' ' ' LYS . 14.2 tppt? -65.46 -39.47 92.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.347 -0.842 . . . . 70.099999999999994 110.453 175.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.403 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 20.8 mmt180 -71.06 -38.56 72.49 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.654 -0.703 . . . . 50.240000000000002 111.85 176.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.47 ' O ' HG13 ' A' ' 49' ' ' ILE . 33.3 m -67.86 -40.4 83.63 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.665 0.603 . . . . 74.200000000000003 111.647 -177.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.614 HD22 ' HG2' ' A' ' 24' ' ' MET . 21.4 mt -70.06 -28.76 65.71 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.949 0.351 . . . . 62.030000000000001 111.949 178.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.09 -25.57 62.67 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 123.423 0.452 . . . . 72.219999999999999 111.427 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 44' ' ' ARG . 43.5 mmtm -73.72 -49.38 25.89 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 122.433 0.293 . . . . 71.530000000000001 111.327 176.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.514 HD11 HD21 ' A' ' 12' ' ' LEU . 0.2 OUTLIER -95.42 3.45 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 112.285 0.476 . . . . 75.200000000000003 112.285 -169.504 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.415 ' HB3' ' HD3' ' A' ' 51' ' ' PRO . . . -52.64 -48.69 89.68 Favored Pre-proline 0 CA--C 1.556 1.206 0 N-CA-C 114.019 1.118 . . . . 72.549999999999997 114.019 171.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.415 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 2.8 Cg_exo -80.59 -3.81 12.63 Favored 'Trans proline' 0 C--N 1.379 2.157 0 CA-C-N 121.917 1.72 . . . . 74.540000000000006 113.977 173.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.7 HD11 HG12 ' A' ' 2' ' ' ILE . 77.5 mt -104.86 81.72 1.79 Allowed 'General case' 0 C--N 1.34 0.173 0 CA-C-O 121.086 0.469 . . . . 64.430000000000007 110.195 -177.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.854 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 2.7 t -87.13 87.68 7.51 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.165 0.802 . . . . 74.409999999999997 113.165 -173.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.436 ' OE2' ' HG3' ' A' ' 20' ' ' LYS . 17.0 mm-40 79.72 -66.15 0.17 Allowed 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 124.976 1.31 . . . . 75.019999999999996 113.395 162.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -70.91 -31.19 67.73 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.475 0.71 . . . . 73.420000000000002 110.242 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.417 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 1.8 mm-40 -76.52 -28.35 56.33 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.564 -0.744 . . . . 74.540000000000006 110.505 178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -72.03 -25.54 61.85 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.496 0.718 . . . . 72.150000000000006 110.765 174.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.26 -20.69 61.49 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 111.969 0.359 . . . . 74.109999999999999 111.969 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.16 -41.61 84.17 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.189 0.519 . . . . 71.230000000000004 110.766 168.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.544 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.0 mt -85.93 -61.46 1.75 Allowed 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 114.823 -1.08 . . . . 73.430000000000007 110.607 -171.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.17 35.34 19.6 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 124.902 1.376 . . . . 73.319999999999993 112.772 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp 64.39 104.9 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.948 1.299 . . . . 64.200000000000003 110.767 -172.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 13.2 m-85 -93.21 -60.97 1.66 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.729 -0.669 . . . . 71.420000000000002 111.675 177.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -87.27 80.12 8.33 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.865 0.84 . . . . 72.310000000000002 112.122 -171.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -124.09 8.61 8.62 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.101 -0.954 . . . . 43.409999999999997 110.657 177.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -88.69 -33.53 17.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.59 -0.732 . . . . 71.319999999999993 110.296 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 71' ' ' HIS . 38.7 mt-10 -89.04 -12.81 40.27 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.54 0.57 . . . . 74.409999999999997 112.54 -175.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.853 HG13 HG22 ' A' ' 6' ' ' ILE . 6.2 m -86.28 -1.01 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 113.066 0.765 . . . . 64.010000000000005 113.066 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.0 mt -61.75 -37.12 83.08 Favored 'General case' 0 C--N 1.343 0.318 0 O-C-N 124.036 0.835 . . . . 73.530000000000001 111.475 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -129.07 21.04 5.81 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 121.634 0.731 . . . . 54.520000000000003 110.809 176.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 67' ' ' GLU . 2.6 t-80 -91.9 -20.14 21.73 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.378 -0.827 . . . . 75.5 110.194 176.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 -100.28 93.48 5.71 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.94 -0.763 . . . . 73.25 108.94 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -90.83 145.75 24.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.977 -1.011 . . . . 74.030000000000001 108.865 -177.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -67.46 132.03 46.84 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.367 0.603 . . . . 73.540000000000006 111.886 -174.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -110.34 -11.33 14.54 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.084 -0.71 . . . . 75.140000000000001 109.084 170.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 18.6 m80 . . . . . 0 C--O 1.237 0.416 0 CA-C-N 115.842 -0.617 . . . . 64.019999999999996 110.113 173.163 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.3 mtt . . . . . 0 N--CA 1.484 1.256 0 CA-C-O 120.652 0.263 . . . . 72.140000000000001 110.546 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.543 HG23 ' HG ' ' A' ' 4' ' ' LEU . 12.1 tt -132.54 146.32 33.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 N-CA-C 108.167 -1.049 . . . . 64.019999999999996 108.167 168.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -82.3 96.97 8.07 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 121.752 0.787 . . . . 73.019999999999996 110.446 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.543 ' HG ' HG23 ' A' ' 2' ' ' ILE . 77.6 mt -106.82 150.78 26.0 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.63 -1.168 . . . . 63.130000000000003 110.039 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -74.09 161.8 29.65 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.512 -0.551 . . . . 35.140000000000001 109.512 168.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.418 ' HA ' ' OG1' ' A' ' 9' ' ' THR . 13.5 mm -80.28 -9.26 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.275 0.56 . . . . 73.510000000000005 110.908 -175.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.09 -34.78 73.58 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.905 -0.497 . . . . 71.430000000000007 110.58 169.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 8.2 mm-40 -66.29 -49.14 68.09 Favored 'General case' 0 C--O 1.215 -0.737 0 O-C-N 123.756 0.66 . . . . 60.43 109.343 178.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.455 ' HB ' HG23 ' A' ' 62' ' ' ILE . 1.9 p -69.87 -26.89 64.41 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 123.943 0.777 . . . . 60.409999999999997 112.884 -177.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.31 -40.4 77.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 120.511 0.195 . . . . 71.239999999999995 111.056 174.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 40.1 tp -67.35 -38.94 85.62 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.225 0.61 . . . . 64.140000000000001 110.824 174.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 92.1 mt -65.71 -31.81 73.02 Favored 'General case' 0 C--O 1.213 -0.821 0 CA-C-N 115.14 -0.937 . . . . 75.25 112.003 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -69.53 -32.26 70.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.369 0.668 . . . . 71.299999999999997 111.762 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 74.9 mt -68.77 -46.71 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 120.955 0.407 . . . . 73.209999999999994 110.283 178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -105.29 26.97 8.73 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.864 0.691 . . . . 74.409999999999997 112.864 -173.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.686 ' HA ' HD21 ' A' ' 23' ' ' LEU . 66.2 t30 -71.09 103.92 2.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.323 0.583 . . . . 71.519999999999996 111.263 -175.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -90.68 -22.7 21.02 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.646 -1.161 . . . . 74.0 109.892 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 140.03 -38.23 1.63 Allowed Glycine 0 C--N 1.336 0.555 0 C-N-CA 120.847 -0.692 . . . . 54.240000000000002 113.269 177.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.46 ' HA3' ' OE2' ' A' ' 54' ' ' GLU . . . -137.38 179.66 17.86 Favored Glycine 0 CA--C 1.504 -0.621 0 C-N-CA 121.174 -0.536 . . . . 54.240000000000002 111.967 -177.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.716 ' HD3' HG22 ' A' ' 49' ' ' ILE . 0.6 OUTLIER -77.59 -29.2 51.9 Favored 'General case' 0 C--O 1.225 -0.199 0 CA-C-N 116.9 0.35 . . . . 74.129999999999995 110.904 -172.538 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.1 ttp180 -66.51 -47.84 71.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 123.835 0.71 . . . . 74.400000000000006 110.371 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.51 -32.88 82.97 Favored Glycine 0 C--N 1.339 0.74 0 CA-C-N 115.637 -0.711 . . . . 64.349999999999994 113.265 176.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.686 HD21 ' HA ' ' A' ' 16' ' ' ASN . 1.1 mm? -67.72 -40.65 84.23 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.35 0.5 . . . . 44.409999999999997 112.35 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.404 ' O ' ' HB2' ' A' ' 28' ' ' ASN . 96.0 mtp -69.36 -28.91 66.61 Favored 'General case' 0 C--O 1.219 -0.544 0 O-C-N 123.053 0.22 . . . . 73.109999999999999 111.582 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -73.43 -43.46 60.33 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.191 0.196 . . . . 54.140000000000001 111.359 173.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.17 -42.53 99.42 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 74.239999999999995 111.867 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.745 HG23 ' HB1' ' A' ' 42' ' ' ALA . 83.1 mt -71.82 -42.85 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.053 -0.521 . . . . 75.409999999999997 111.518 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 24' ' ' MET . 7.1 t-20 -62.62 -41.6 99.1 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.184 0.594 . . . . 74.5 111.96 -176.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.98 -34.6 50.83 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.91 -0.586 . . . . 74.209999999999994 112.049 -177.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -97.18 18.03 15.88 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 113.242 0.83 . . . . 73.310000000000002 113.242 -171.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -54.02 -53.22 60.79 Favored Pre-proline 0 CA--C 1.558 1.276 0 N-CA-C 113.51 0.93 . . . . 44.210000000000001 113.51 177.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -76.24 -7.83 18.26 Favored 'Trans proline' 0 C--N 1.382 2.329 0 CA-C-N 121.18 1.457 . . . . 73.200000000000003 113.954 175.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.518 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 92.5 m-85 -90.01 -30.91 17.45 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 122.518 0.327 . . . . 72.540000000000006 111.769 -175.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.523 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 63.5 mtt -67.53 -75.78 0.09 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 122.969 0.508 . . . . 65.430000000000007 111.817 -177.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.416 ' HB3' ' HB2' ' A' ' 38' ' ' MET . 18.7 t70 179.64 169.74 1.11 Allowed 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 104.96 -2.237 . . . . 44.119999999999997 104.96 -172.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.07 -40.04 47.62 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 119.04 0.836 . . . . 64.140000000000001 110.852 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -70.49 -41.7 72.33 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.225 0.536 . . . . 73.340000000000003 111.027 178.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.416 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 4.2 tpt -69.97 -26.84 64.29 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 114.96 -1.018 . . . . 72.510000000000005 111.22 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -69.14 -42.69 75.66 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.477 0.711 . . . . 74.439999999999998 111.552 176.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -65.0 -34.56 78.72 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.562 0.539 . . . . 71.129999999999995 111.116 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.6 tp -66.11 -48.99 69.08 Favored 'General case' 0 C--O 1.216 -0.694 0 O-C-N 123.888 0.743 . . . . 71.319999999999993 110.444 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.745 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -58.85 -41.01 85.97 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.628 1.171 . . . . 60.219999999999999 114.06 -174.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -67.03 -34.89 78.69 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.337 0.398 . . . . 73.310000000000002 111.69 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -76.27 -34.23 59.14 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.148 -0.478 . . . . 74.010000000000005 111.443 178.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.458 HG22 HD11 ' A' ' 49' ' ' ILE . 7.5 m -65.85 -37.09 85.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.072 0.549 . . . . 61.140000000000001 110.741 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 74.3 mt -61.74 -34.05 75.14 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.343 0.868 . . . . 74.010000000000005 113.343 178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.18 -22.02 62.08 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.903 0.382 . . . . 55.210000000000001 111.62 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -88.5 -29.73 19.89 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.083 -0.508 . . . . 73.409999999999997 111.509 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.716 HG22 ' HD3' ' A' ' 20' ' ' LYS . 25.6 mt -91.95 -24.81 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 111.357 0.132 . . . . 65.420000000000002 111.357 -176.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.02 -46.49 97.6 Favored Pre-proline 0 CA--C 1.557 1.213 0 N-CA-C 114.699 1.37 . . . . 73.530000000000001 114.699 177.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -80.31 3.89 7.28 Favored 'Trans proline' 0 C--N 1.38 2.201 0 C-N-CA 121.64 1.56 . . . . 74.430000000000007 114.748 176.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.563 HD22 ' HG2' ' A' ' 56' ' ' GLU . 78.9 mt -88.79 169.14 11.87 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 109.444 -0.576 . . . . 74.120000000000005 109.444 177.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.5 p -103.58 174.27 5.94 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.376 -0.374 . . . . 73.510000000000005 110.314 173.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.46 ' OE2' ' HA3' ' A' ' 19' ' ' GLY . 54.4 tp10 -66.1 -36.51 83.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.886 -0.597 . . . . 74.430000000000007 110.565 175.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.484 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 52.0 m-80 -74.12 -32.68 63.29 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 115.828 -0.624 . . . . 65.200000000000003 111.859 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.563 ' HG2' HD22 ' A' ' 52' ' ' LEU . 8.0 tp10 -65.75 -37.03 85.25 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.805 0.442 . . . . 75.219999999999999 111.769 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.553 ' HB2' ' HB3' ' A' ' 20' ' ' LYS . 45.6 t80 -69.83 -32.95 71.65 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.4 -0.363 . . . . 53.329999999999998 110.654 176.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.25 -22.86 57.54 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.123 0.416 . . . . 63.210000000000001 112.123 178.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 13.9 mm-40 -68.0 -39.03 83.31 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 109.825 -0.435 . . . . 65.340000000000003 109.825 171.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.444 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 74.9 mt -71.58 -57.06 4.74 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 115.537 -0.756 . . . . 61.43 110.631 178.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 59.41 20.46 8.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.238 1.415 . . . . 73.150000000000006 112.788 -179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.455 HG23 ' HB ' ' A' ' 9' ' ' THR . 5.2 mp 56.63 88.37 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 124.767 1.227 . . . . 72.109999999999999 110.066 -167.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 55.5 m-85 -68.44 -42.04 79.44 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.44 -0.8 . . . . 73.230000000000004 111.344 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.401 ' HB3' HD12 ' A' ' 6' ' ' ILE . . . -122.21 106.8 11.46 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.774 -0.648 . . . . 51.439999999999998 111.926 -171.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -143.14 -1.66 1.05 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.679 -0.692 . . . . 63.229999999999997 109.946 169.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -100.69 -32.62 10.64 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 115.747 -0.661 . . . . 62.229999999999997 111.792 -169.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -18.23 54.51 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.094 0.405 . . . . 73.430000000000007 112.094 -179.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 m -87.06 2.57 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-O 120.756 0.312 . . . . 75.099999999999994 111.804 172.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -91.94 4.84 52.08 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.221 -0.445 . . . . 75.409999999999997 110.677 173.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -70.95 -32.36 69.21 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.338 0.655 . . . . 75.549999999999997 109.589 170.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -59.21 123.14 15.69 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 114.932 -1.031 . . . . 75.340000000000003 110.353 174.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -75.53 144.83 41.74 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.542 -0.754 . . . . 51.439999999999998 110.232 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.1 m80 72.57 115.61 0.05 Allowed 'General case' 0 N--CA 1.487 1.38 0 O-C-N 125.118 1.511 . . . . 75.040000000000006 111.118 -174.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 36.7 m170 -89.75 176.93 6.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.297 -0.865 . . . . 73.530000000000001 110.73 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -123.82 46.98 2.12 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.519 -0.764 . . . . 74.109999999999999 110.412 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 24.4 t60 . . . . . 0 N--CA 1.484 1.247 0 C-N-CA 124.965 1.306 . . . . 72.340000000000003 110.678 -177.387 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.503 ' HG3' HD21 ' A' ' 60' ' ' LEU . 27.1 ttt . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 110.008 -0.367 . . . . 63.409999999999997 110.008 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.9 pt -80.06 134.63 27.1 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 109.463 -0.569 . . . . 63.420000000000002 109.463 173.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -97.15 97.47 9.22 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.234 -0.654 . . . . 72.219999999999999 109.234 -177.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.548 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 76.1 mt -98.34 161.56 13.63 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.968 -1.015 . . . . 75.450000000000003 109.613 178.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.1 t -99.31 -174.49 2.75 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.916 -0.772 . . . . 72.219999999999999 108.916 176.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.512 HG21 ' HB2' ' A' ' 67' ' ' GLU . 4.1 mp -63.85 -30.9 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 123.645 0.778 . . . . 71.019999999999996 112.324 -171.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -65.5 -47.17 76.91 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.642 0.377 . . . . 63.530000000000001 111.462 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.565 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 2.2 mp0 -68.38 -37.1 80.08 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.403 0.439 . . . . 65.420000000000002 111.542 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 6.4 m -73.73 -29.5 62.28 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 123.292 0.37 . . . . 55.25 111.478 -178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -69.55 -35.32 75.33 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.858 0.463 . . . . 70.209999999999994 110.461 173.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.501 HD21 ' HA ' ' A' ' 42' ' ' ALA . 14.3 tp -67.23 -40.24 86.34 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.164 -0.471 . . . . 72.019999999999996 110.813 174.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.634 ' HA ' HD11 ' A' ' 23' ' ' LEU . 88.5 mt -61.34 -38.95 88.78 Favored 'General case' 0 C--O 1.218 -0.582 0 O-C-N 123.763 0.665 . . . . 73.150000000000006 110.824 174.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.7 t -64.21 -34.01 77.11 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.114 0.966 . . . . 64.450000000000003 112.259 -178.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 88.4 mt -74.29 -43.63 49.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 O-C-N 123.299 0.375 . . . . 64.239999999999995 111.228 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.492 ' CD1' ' HB3' ' A' ' 26' ' ' ASN . 78.9 m-85 -109.61 21.79 16.53 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 113.273 0.842 . . . . 75.010000000000005 113.273 -167.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 61.3 t30 -87.1 114.66 23.9 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.268 0.556 . . . . 74.519999999999996 111.361 -177.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.459 ' HB2' ' HA3' ' A' ' 22' ' ' GLY . 28.0 mm-40 -97.82 6.12 48.24 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.369 -0.832 . . . . 65.030000000000001 111.624 176.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 100.51 51.8 1.18 Allowed Glycine 0 N--CA 1.445 -0.74 0 N-CA-C 110.914 -0.874 . . . . 61.130000000000003 110.914 -175.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 143.55 167.47 11.72 Favored Glycine 0 N--CA 1.448 -0.532 0 N-CA-C 111.826 -0.509 . . . . 64.200000000000003 111.826 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.39 -18.12 57.59 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 111.918 0.34 . . . . 72.230000000000004 111.918 -176.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.472 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 48.0 ttm-85 -64.72 -44.1 91.29 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.514 -0.766 . . . . 62.530000000000001 109.776 176.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.459 ' HA3' ' HB2' ' A' ' 17' ' ' GLU . . . -61.22 -31.61 77.6 Favored Glycine 0 C--N 1.341 0.838 0 O-C-N 124.014 0.821 . . . . 62.409999999999997 113.612 174.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.634 HD11 ' HA ' ' A' ' 12' ' ' LEU . 3.9 mm? -65.81 -43.63 88.09 Favored 'General case' 0 C--O 1.219 -0.501 0 C-N-CA 122.548 0.339 . . . . 73.310000000000002 111.703 175.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 54.4 mtt -73.64 -35.4 65.29 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.156 0.428 . . . . 75.209999999999994 112.156 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 47.1 mm-40 -65.54 -50.35 65.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.647 0.261 . . . . 65.049999999999997 111.41 175.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.492 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 7.4 m-80 -69.71 -42.48 73.98 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.167 0.802 . . . . 63.350000000000001 113.167 -174.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.544 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 54.9 mt -68.73 -48.53 70.78 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.591 0 CA-C-O 118.84 -0.6 . . . . 74.329999999999998 111.763 -178.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -66.63 -30.19 70.41 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 113.361 0.875 . . . . 72.310000000000002 113.361 -175.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.29 -37.86 25.21 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.679 0.251 . . . . 31.140000000000001 111.679 177.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.704 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.43 19.09 15.06 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.579 0.585 . . . . 73.140000000000001 112.579 -174.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 51.6 mt -56.32 -51.99 76.61 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-O 118.12 -0.943 . . . . 62.340000000000003 112.48 173.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -67.5 -15.53 45.33 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.025 1.817 . . . . 71.519999999999996 114.027 174.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.704 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.7 m-85 -90.88 -5.01 56.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.941 0.496 . . . . 64.140000000000001 111.267 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 60.3 mtt -84.2 171.73 12.53 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 110.019 -0.363 . . . . 64.519999999999996 110.019 173.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.27 -77.34 0.14 Allowed 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.384 -0.371 . . . . 70.329999999999998 111.216 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -175.94 -47.01 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.11 0.964 . . . . 60.210000000000001 108.779 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -67.6 -42.41 82.49 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.11 -0.95 . . . . 64.340000000000003 109.912 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 2.0 tpt -71.65 -27.04 62.81 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.574 -0.739 . . . . 64.150000000000006 111.572 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 39' ' ' ARG . 42.2 ttm180 -74.98 -46.58 34.37 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.022 0.529 . . . . 75.219999999999999 111.591 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -62.89 -34.41 77.36 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.069 0.461 . . . . 73.019999999999996 111.471 175.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.0 tp -66.72 -41.63 87.62 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 115.224 -0.898 . . . . 71.409999999999997 110.902 175.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.501 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -63.64 -38.11 89.88 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 113.456 0.909 . . . . 72.150000000000006 113.456 -175.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.6 ttmm -64.12 -42.91 96.66 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 123.636 0.585 . . . . 64.310000000000002 111.178 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 -73.02 -34.6 66.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.709 -0.678 . . . . 74.299999999999997 112.334 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.423 ' O ' HG13 ' A' ' 49' ' ' ILE . 35.0 m -71.34 -41.39 69.88 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.599 -0.273 . . . . 73.109999999999999 110.971 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.2 mt -65.36 -29.38 70.1 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.656 0.613 . . . . 62.530000000000001 112.656 179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.08 -19.74 62.43 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.156 0.428 . . . . 51.43 112.156 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.05 -29.21 22.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.316 0.246 . . . . 65.219999999999999 111.609 176.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 45' ' ' THR . 4.2 mt -90.17 -14.79 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-O 120.851 0.358 . . . . 65.010000000000005 110.683 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -47.02 99.41 Favored Pre-proline 0 CA--C 1.556 1.192 0 N-CA-C 114.013 1.116 . . . . 72.329999999999998 114.013 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -75.58 7.05 3.26 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 121.675 1.583 . . . . 64.239999999999995 114.484 172.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.3 mt -106.19 174.26 5.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.886 0.374 . . . . 52.100000000000001 110.517 176.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.6 p -112.01 -168.11 1.27 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.69 -0.856 . . . . 72.510000000000005 108.69 167.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -87.36 -7.8 57.35 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 110.534 -0.173 . . . . 70.209999999999994 110.534 175.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -72.93 -47.73 43.14 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 109.703 -0.48 . . . . 73.0 109.703 170.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -71.27 -29.43 65.06 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.534 . . . . 64.340000000000003 111.701 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -69.42 -36.92 77.16 Favored 'General case' 0 C--O 1.217 -0.629 0 O-C-N 123.278 0.361 . . . . 74.340000000000003 110.597 174.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.16 -17.48 60.91 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.031 0.382 . . . . 72.409999999999997 112.031 -177.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -66.76 -37.29 84.33 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.117 -0.492 . . . . 74.230000000000004 110.826 169.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.551 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 43.2 mt -83.26 -59.65 2.4 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.72 -0.673 . . . . 71.040000000000006 110.799 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.87 -107.22 0.35 Allowed 'General case' 0 C--N 1.344 0.361 0 O-C-N 125.251 1.594 . . . . 44.43 110.67 -171.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 31.2 mm -126.1 98.64 5.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.674 -0.862 . . . . 73.049999999999997 108.674 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.551 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 4.7 m-85 -91.87 -85.94 0.24 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.172 -0.467 . . . . 71.109999999999999 111.927 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' ILE . . . -96.5 82.83 3.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.264 0.554 . . . . 75.200000000000003 110.99 -174.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -135.44 5.25 3.19 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.577 -0.738 . . . . 65.409999999999997 110.124 173.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -96.14 9.75 39.92 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.276 -0.875 . . . . 64.510000000000005 110.547 176.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.512 ' HB2' HG21 ' A' ' 6' ' ' ILE . 7.9 mm-40 -94.87 -3.32 49.0 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.338 -0.846 . . . . 70.409999999999997 110.623 178.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -102.47 11.16 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.201 -0.454 . . . . 65.439999999999998 111.018 176.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.2 mt -79.89 -23.19 42.03 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.886 0.374 . . . . 74.450000000000003 110.434 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.46 -43.06 93.3 Favored 'General case' 0 C--N 1.341 0.213 0 C-N-CA 124.255 1.022 . . . . 65.0 110.582 173.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 30.5 m170 -85.46 139.38 31.55 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.344 -0.844 . . . . 64.239999999999995 109.137 176.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 71.7 t60 -76.41 121.09 22.55 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.193 0.521 . . . . 64.299999999999997 110.703 -177.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -128.27 109.91 11.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.886 -1.052 . . . . 61.439999999999998 110.271 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -80.88 95.53 6.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.923 0.868 . . . . 63.439999999999998 109.637 177.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -161.34 -51.23 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 113.933 -1.485 . . . . 74.230000000000004 107.58 -178.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 75.2 t60 . . . . . 0 C--O 1.236 0.36 0 CA-C-N 115.023 -0.99 . . . . 65.549999999999997 108.522 177.501 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 120.655 0.264 . . . . 71.109999999999999 110.614 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.9 tt -92.03 141.82 13.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 108.98 -0.748 . . . . 74.219999999999999 108.98 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -94.27 92.54 7.27 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-O 121.426 0.632 . . . . 71.510000000000005 109.316 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 86.0 mt -105.83 152.36 23.34 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 114.919 -1.037 . . . . 73.329999999999998 108.624 171.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -74.01 156.94 37.0 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.584 -0.735 . . . . 73.209999999999994 109.519 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.901 HG21 ' HB2' ' A' ' 67' ' ' GLU . 6.1 mm -64.24 -32.85 59.13 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.424 0 C-N-CA 122.64 0.376 . . . . 72.049999999999997 111.142 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -69.7 -34.66 74.21 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.14 -0.482 . . . . 74.109999999999999 111.211 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 39.0 mt-10 -69.71 -41.82 74.86 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.584 0.553 . . . . 73.329999999999998 111.199 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.5 ' HA ' HD12 ' A' ' 12' ' ' LEU . 2.3 m -75.35 -24.89 57.38 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.482 0.489 . . . . 65.129999999999995 111.506 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -67.46 -36.74 81.75 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.259 -0.276 . . . . 73.019999999999996 110.863 169.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.549 HD13 ' HG2' ' A' ' 38' ' ' MET . 46.2 tp -64.66 -36.52 84.53 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.069 0.548 . . . . 64.299999999999997 110.074 173.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.776 ' HA ' HD11 ' A' ' 23' ' ' LEU . 81.7 mt -67.11 -39.64 86.71 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.259 -0.882 . . . . 73.420000000000002 111.091 173.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.408 ' HA ' HD12 ' A' ' 62' ' ' ILE . 22.8 t -69.41 -26.16 64.49 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.964 0.906 . . . . 75.519999999999996 112.919 -178.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 73.8 mt -79.38 -35.23 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 122.277 0.231 . . . . 52.43 110.622 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -114.96 24.64 11.55 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.913 0.709 . . . . 74.230000000000004 112.913 -173.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 64.4 t30 -85.26 90.48 7.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.384 0.611 . . . . 54.229999999999997 110.112 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -114.67 -25.22 8.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.922 -1.035 . . . . 73.099999999999994 111.275 -176.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -169.87 64.86 0.17 Allowed Glycine 0 C--N 1.334 0.445 0 C-N-CA 120.004 -1.093 . . . . 32.200000000000003 113.489 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.16 -155.49 47.67 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 111.608 -0.597 . . . . 65.530000000000001 111.608 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.494 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 2.6 pptp? -83.51 -11.71 57.12 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 117.211 0.505 . . . . 75.109999999999999 110.324 -179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 ttp85 -68.35 -53.27 25.21 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.194 -0.669 . . . . 74.310000000000002 109.194 170.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.9 -32.93 76.44 Favored Glycine 0 C--N 1.342 0.898 0 O-C-N 124.392 1.058 . . . . 60.130000000000003 113.442 173.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.776 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.6 mm? -68.14 -49.71 59.29 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 117.11 0.455 . . . . 61.420000000000002 112.196 176.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.507 ' HG2' HD22 ' A' ' 46' ' ' LEU . 50.7 mtt -66.72 -34.16 77.23 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.518 0.562 . . . . 71.519999999999996 112.518 -176.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -70.07 -51.22 33.7 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 122.33 0.252 . . . . 75.409999999999997 111.556 175.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -76.66 -29.25 56.3 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.997 0.74 . . . . 72.409999999999997 112.997 -170.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.464 HD11 HD12 ' A' ' 23' ' ' LEU . 60.6 mt -69.04 -50.45 53.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 CA-C-N 117.88 0.309 . . . . 75.150000000000006 110.447 175.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -67.61 -33.33 74.78 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.113 0.783 . . . . 61.420000000000002 113.113 -176.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.99 -33.48 61.86 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.776 0.322 . . . . 73.400000000000006 111.637 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.718 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.15 19.52 19.41 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.542 0.571 . . . . 71.409999999999997 112.542 -176.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.445 HD23 ' HE3' ' A' ' 34' ' ' MET . 61.1 mt -56.4 -50.12 89.47 Favored Pre-proline 0 CA--C 1.55 0.947 0 CA-C-O 118.266 -0.873 . . . . 74.109999999999999 112.502 171.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.99 -23.6 53.87 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 121.656 1.57 . . . . 73.329999999999998 113.923 174.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.718 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.0 m-85 -77.78 -36.46 50.43 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 122.803 0.441 . . . . 60.5 111.628 -177.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.445 ' HE3' HD23 ' A' ' 31' ' ' LEU . 22.3 ptp -82.21 168.81 17.28 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.714 0.292 . . . . 62.329999999999998 110.787 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -72.28 154.27 41.07 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.872 -0.603 . . . . 63.32 109.521 176.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 39' ' ' ARG . 29.1 tt0 -70.44 -20.19 62.92 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.673 0.619 . . . . 61.409999999999997 112.673 -175.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -65.77 -44.8 84.73 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.006 0.431 . . . . 72.329999999999998 110.415 172.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.549 ' HG2' HD13 ' A' ' 11' ' ' LEU . 0.7 OUTLIER -76.27 -25.16 54.67 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 115.034 -0.985 . . . . 74.120000000000005 111.009 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.439 ' HB3' ' HA ' ' A' ' 36' ' ' GLU . 35.8 ttm180 -71.86 -44.71 63.34 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.3 1.04 . . . . 72.129999999999995 111.471 -179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -71.26 -29.95 65.71 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.742 0.417 . . . . 74.099999999999994 111.462 174.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 16.1 tp -61.57 -34.05 74.92 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.201 -0.909 . . . . 75.349999999999994 111.381 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.07 -33.48 75.89 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 113.548 0.944 . . . . 62.130000000000003 113.548 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.07 -38.8 92.61 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.11 0.481 . . . . 73.140000000000001 110.434 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.44 HH11 ' HD3' ' A' ' 44' ' ' ARG . 39.3 mtt180 -71.32 -53.53 13.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.959 -1.019 . . . . 54.140000000000001 112.213 178.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.8 m -61.41 -44.97 96.21 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.651 0.78 . . . . 70.150000000000006 112.733 -172.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.507 HD22 ' HG2' ' A' ' 24' ' ' MET . 96.3 mt -64.94 -27.43 68.84 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.783 0.661 . . . . 65.010000000000005 112.783 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.64 -23.4 64.43 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.857 0.688 . . . . 73.430000000000007 112.857 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.32 -27.6 29.64 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.693 0.224 . . . . 60.130000000000003 110.997 177.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.446 ' HA ' HD12 ' A' ' 52' ' ' LEU . 3.0 mt -97.17 -12.09 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-O 121.041 0.448 . . . . 73.400000000000006 110.904 -173.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.36 -44.12 97.57 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 114.341 1.237 . . . . 73.129999999999995 114.341 173.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -79.51 11.23 2.75 Favored 'Trans proline' 0 C--N 1.383 2.361 0 CA-C-N 122.152 1.804 . . . . 73.430000000000007 114.307 170.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 49' ' ' ILE . 95.8 mt -108.29 -179.66 3.95 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 122.762 0.425 . . . . 63.350000000000001 110.118 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.457 HG23 ' OD1' ' A' ' 55' ' ' ASN . 6.4 t -139.11 -169.95 2.77 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 108.471 -0.937 . . . . 73.450000000000003 108.471 174.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -64.79 -43.39 93.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.53 0.732 . . . . 71.340000000000003 112.7 -167.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.457 ' OD1' HG23 ' A' ' 53' ' ' THR . 30.7 p-10 -67.78 -32.45 73.03 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 123.678 0.612 . . . . 72.430000000000007 112.285 -177.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -67.17 -41.64 85.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 123.733 0.646 . . . . 71.329999999999998 111.844 178.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.593 ' HE1' HD13 ' A' ' 12' ' ' LEU . 88.5 t80 -75.29 -38.46 60.36 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.477 0.486 . . . . 75.420000000000002 111.467 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.81 -24.04 66.83 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 113.807 1.04 . . . . 71.450000000000003 113.807 -168.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.08 -34.08 43.92 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.584 0.216 . . . . 73.299999999999997 111.584 175.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 mt -75.85 -56.38 4.73 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.238 -0.653 . . . . 73.049999999999997 109.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.58 -108.52 0.42 Allowed 'General case' 0 C--N 1.346 0.425 0 O-C-N 125.498 1.749 . . . . 73.209999999999994 113.17 176.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.408 HD12 ' HA ' ' A' ' 13' ' ' SER . 17.1 mm -113.2 88.31 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.072 -1.085 . . . . 55.020000000000003 108.072 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -103.64 -10.64 18.24 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.48 -0.782 . . . . 71.409999999999997 112.01 -175.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -146.44 82.04 1.58 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 51.509999999999998 111.339 -177.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -133.63 19.48 3.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.552 -0.749 . . . . 64.040000000000006 109.192 170.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -78.98 -42.76 25.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.967 -1.015 . . . . 72.319999999999993 111.201 -177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.901 ' HB2' HG21 ' A' ' 6' ' ' ILE . 24.6 mm-40 -80.71 -14.43 58.13 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.894 0.702 . . . . 72.310000000000002 112.894 -174.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 30.4 m -91.74 2.76 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 N-CA-C 111.918 0.34 . . . . 55.409999999999997 111.918 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 83.2 mt -76.39 145.29 39.49 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.389 -0.369 . . . . 65.219999999999999 110.245 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 76.72 -20.66 0.36 Allowed 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 126.194 1.797 . . . . 63.25 111.791 -171.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 44.9 m80 -85.67 73.78 10.37 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.076 0.55 . . . . 70.010000000000005 111.129 -178.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 53.66 51.06 15.76 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.283 1.433 . . . . 73.349999999999994 112.387 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -79.25 135.66 36.83 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.177 -0.92 . . . . 75.25 109.675 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 35.7 t-80 -68.68 136.44 52.91 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.581 -0.736 . . . . 73.219999999999999 109.899 178.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -66.22 113.74 4.79 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 123.61 0.569 . . . . 71.420000000000002 109.872 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 16.1 t60 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.712 -0.676 . . . . 73.209999999999994 110.386 -174.378 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 109.231 -0.655 . . . . 71.319999999999993 109.231 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.6 pt -104.59 154.38 6.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-N 115.892 -0.594 . . . . 75.540000000000006 110.501 177.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -93.71 112.09 23.89 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 107.85 -1.167 . . . . 74.430000000000007 107.85 178.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.597 HD21 ' HG3' ' A' ' 48' ' ' LYS . 85.7 mt -98.12 159.46 14.92 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.119 -0.946 . . . . 72.299999999999997 111.527 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' HG2' ' A' ' 8' ' ' GLU . 14.9 t -90.3 166.78 13.13 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.389 -0.823 . . . . 55.520000000000003 109.004 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.3 mm -69.41 -27.35 33.98 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 116.228 -0.442 . . . . 64.230000000000004 110.715 -174.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -66.54 -45.59 78.9 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.592 0.757 . . . . 71.209999999999994 112.378 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.479 ' HG2' HG22 ' A' ' 5' ' ' THR . 43.0 mm-40 -64.29 -43.91 93.27 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.556 0.535 . . . . 65.519999999999996 110.362 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.69 ' HA ' HD12 ' A' ' 12' ' ' LEU . 3.1 m -73.46 -26.54 60.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.777 -1.101 . . . . 61.210000000000001 111.325 -176.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.437 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.8 t-20 -69.44 -36.51 76.71 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.005 0.522 . . . . 73.140000000000001 111.45 178.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.623 HD12 HD12 ' A' ' 14' ' ' ILE . 38.0 tp -74.01 -33.17 63.69 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.879 0.371 . . . . 72.530000000000001 110.538 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.69 HD12 ' HA ' ' A' ' 9' ' ' THR . 69.4 mt -63.53 -35.32 80.07 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-N 115.634 -0.712 . . . . 74.530000000000001 110.622 170.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.7 t -70.68 -24.55 62.7 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.526 0.73 . . . . 74.230000000000004 111.988 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.623 HD12 HD12 ' A' ' 11' ' ' LEU . 96.6 mt -69.93 -34.38 59.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 123.006 0.522 . . . . 43.310000000000002 110.266 175.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -107.39 -84.95 0.52 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.26 -0.4 . . . . 70.530000000000001 111.309 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.606 ' HA ' HD21 ' A' ' 23' ' ' LEU . 64.3 t30 57.13 83.83 0.1 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.389 1.476 . . . . 62.0 111.829 179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.478 ' H ' HD22 ' A' ' 23' ' ' LEU . 38.5 tt0 -149.53 123.63 9.46 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 114.763 -1.108 . . . . 72.409999999999997 110.03 -177.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.17 24.02 74.53 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 115.535 0.974 . . . . 71.420000000000002 115.535 167.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.92 -150.19 42.35 Favored Glycine 0 C--O 1.221 -0.695 0 C-N-CA 121.153 -0.546 . . . . 71.099999999999994 112.497 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 57' ' ' TYR . 14.2 tmtt? -64.97 -43.35 92.94 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.95 0.5 . . . . 73.129999999999995 111.085 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -72.81 -45.4 58.68 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.051 -0.977 . . . . 74.329999999999998 111.318 -172.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.38 -30.08 74.89 Favored Glycine 0 CA--C 1.524 0.627 0 O-C-N 123.757 0.661 . . . . 75.019999999999996 113.137 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' A' ' 16' ' ' ASN . 0.5 OUTLIER -64.24 -37.89 89.09 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-N 116.821 0.31 . . . . 71.420000000000002 110.905 173.664 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.654 ' HG2' HD22 ' A' ' 46' ' ' LEU . 37.8 mtt -69.42 -39.41 77.88 Favored 'General case' 0 C--O 1.221 -0.415 0 O-C-N 123.234 0.334 . . . . 74.319999999999993 111.505 175.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -63.71 -40.81 97.69 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.693 0.397 . . . . 61.530000000000001 111.723 177.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -77.98 -42.68 32.0 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.712 -0.676 . . . . 71.25 111.174 -175.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.0 mt -72.63 -38.48 58.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 119.107 -0.473 . . . . 74.219999999999999 111.868 -177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -63.36 -35.76 81.47 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 118.254 0.479 . . . . 63.520000000000003 111.693 176.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.21 -19.26 61.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.109 -0.496 . . . . 54.409999999999997 112.307 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.651 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -113.79 17.29 18.17 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.415 0.524 . . . . 52.140000000000001 112.415 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.7 mt -66.51 -44.65 56.55 Favored Pre-proline 0 CA--C 1.55 0.975 0 N-CA-C 113.441 0.904 . . . . 75.219999999999999 113.441 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.26 7.95 2.74 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 121.709 1.606 . . . . 55.140000000000001 114.122 171.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.651 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 95.9 m-85 -114.29 -168.8 1.41 Allowed 'General case' 0 C--O 1.242 0.681 0 C-N-CA 123.12 0.568 . . . . 65.450000000000003 109.618 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 68.0 mtm 68.16 -88.81 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 125.309 1.444 . . . . 75.140000000000001 111.454 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -167.85 164.1 14.05 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 106.832 -1.544 . . . . 75.019999999999996 106.832 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.64 -31.71 71.91 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.043 0.383 . . . . 61.450000000000003 111.734 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.34 -39.01 55.06 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.0 0.52 . . . . 64.019999999999996 110.508 178.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 5.7 mtt -68.03 -28.51 67.46 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 115.914 -0.585 . . . . 54.25 111.882 174.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -71.04 -43.02 68.72 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 123.311 0.645 . . . . 62.210000000000001 111.156 176.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -67.98 -32.17 72.38 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 111.562 0.208 . . . . 73.230000000000004 111.562 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.7 tp -63.72 -48.07 78.56 Favored 'General case' 0 C--O 1.213 -0.846 0 O-C-N 123.644 0.59 . . . . 72.439999999999998 109.653 170.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.63 -34.76 76.24 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.348 1.059 . . . . 53.130000000000003 113.537 -177.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -66.27 -35.97 81.79 Favored 'General case' 0 C--O 1.22 -0.496 0 O-C-N 123.688 0.617 . . . . 75.420000000000002 111.813 177.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -79.75 -28.98 40.38 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.468 0.48 . . . . 74.030000000000001 111.515 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 m -75.35 -30.66 60.31 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 120.945 0.402 . . . . 75.430000000000007 110.39 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.654 HD22 ' HG2' ' A' ' 24' ' ' MET . 67.6 mt -76.71 -31.16 57.02 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.182 0.438 . . . . 70.25 112.182 169.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.42 -33.12 73.65 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.743 0.645 . . . . 74.450000000000003 112.743 -175.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.597 ' HG3' HD21 ' A' ' 4' ' ' LEU . 0.1 OUTLIER -86.4 -17.21 34.95 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.914 0.339 . . . . 71.310000000000002 111.914 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.53 HG22 HD12 ' A' ' 52' ' ' LEU . 31.7 pt -97.82 -8.42 9.16 Favored 'Isoleucine or valine' 0 C--N 1.348 0.543 0 C-N-CA 120.415 -0.514 . . . . 64.400000000000006 112.005 174.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.66 -46.32 99.59 Favored Pre-proline 0 CA--C 1.557 1.216 0 CA-C-O 118.261 -0.876 . . . . 61.340000000000003 113.208 171.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.45 -5.91 15.92 Favored 'Trans proline' 0 C--N 1.381 2.266 0 CA-C-N 121.62 1.614 . . . . 65.120000000000005 114.139 171.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.53 HD12 HG22 ' A' ' 49' ' ' ILE . 76.7 mt -92.17 153.07 19.55 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.886 0.374 . . . . 61.420000000000002 110.115 177.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 20.7 p -95.01 -176.89 3.97 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 116.171 -0.468 . . . . 74.329999999999998 110.982 175.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.56 -30.28 69.87 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.902 -0.59 . . . . 75.549999999999997 111.362 175.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -71.72 -39.4 70.16 Favored 'General case' 0 C--O 1.226 -0.183 0 O-C-N 123.724 0.64 . . . . 72.040000000000006 110.527 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -65.3 -42.04 93.48 Favored 'General case' 0 N--CA 1.466 0.355 0 O-C-N 123.716 0.635 . . . . 64.530000000000001 112.711 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.486 ' HB3' ' HB2' ' A' ' 20' ' ' LYS . 80.1 t80 -75.58 -26.15 57.65 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.052 0.22 . . . . 73.120000000000005 111.218 178.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.96 -29.04 66.06 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.94 0.336 . . . . 70.5 111.341 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.38 -23.44 61.11 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 123.456 0.472 . . . . 75.319999999999993 111.811 173.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 78.7 mt -93.75 -69.06 0.77 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.639 0.376 . . . . 71.310000000000002 111.808 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.94 -135.02 1.46 Allowed 'General case' 0 C--N 1.352 0.709 0 C-N-CA 124.741 1.216 . . . . 72.239999999999995 110.709 -172.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.4 mm -97.1 98.0 6.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 108.002 -1.111 . . . . 74.519999999999996 108.002 172.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 25.8 p90 -117.45 -9.6 10.83 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.334 -0.848 . . . . 71.219999999999999 111.794 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.94 -29.04 3.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.462 0.542 . . . . 74.140000000000001 112.462 -173.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.81 17.51 6.57 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.901 0.704 . . . . 73.129999999999995 112.901 -174.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -82.97 -26.81 30.98 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.011 -0.54 . . . . 73.0 110.57 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -74.82 -20.19 59.88 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 112.819 0.674 . . . . 74.420000000000002 112.819 -174.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.4 m -88.08 -0.19 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 112.213 0.449 . . . . 71.209999999999994 112.213 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.2 mt -86.53 2.72 47.05 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.043 0.449 . . . . 74.409999999999997 111.182 -179.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -80.43 -17.87 50.5 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.532 -0.758 . . . . 54.310000000000002 109.985 172.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -80.17 174.63 11.41 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.012 -0.54 . . . . 74.239999999999995 110.996 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -73.18 111.55 8.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.147 -0.479 . . . . 65.519999999999996 109.882 -177.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 9.9 p80 -120.17 114.13 21.48 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.744 0.783 . . . . 74.409999999999997 112.436 -170.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -105.98 173.16 6.43 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 114.893 -1.049 . . . . 75.409999999999997 110.175 173.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.9 p80 -121.24 117.1 26.19 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.373 0.606 . . . . 54.310000000000002 109.972 171.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.761 -0.654 . . . . 70.239999999999995 109.932 179.33 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 N--CA 1.477 0.922 0 CA-C-O 120.869 0.366 . . . . 72.299999999999997 110.115 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.624 HD12 ' HD2' ' A' ' 48' ' ' LYS . 11.0 pt -127.07 166.94 22.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.435 -0.802 . . . . 74.239999999999995 110.466 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.408 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 18.2 mmt180 -103.91 112.99 26.2 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.548 0.689 . . . . 71.400000000000006 111.104 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 75.8 mt -91.83 148.31 22.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.271 -1.332 . . . . 35.329999999999998 110.401 -179.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 43.8 p -87.33 169.8 11.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.163 -0.471 . . . . 63.25 110.836 177.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.404 HG12 ' HB1' ' A' ' 64' ' ' ALA . 50.5 mt -70.8 -22.49 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 115.743 -0.662 . . . . 71.430000000000007 109.803 177.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.42 -55.04 27.54 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.136 0.575 . . . . 74.329999999999998 111.22 174.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.01 -37.33 69.81 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.675 -0.693 . . . . 72.319999999999993 111.912 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.74 ' HA ' HD12 ' A' ' 12' ' ' LEU . 7.6 m -74.75 -27.82 60.51 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 116.402 -0.363 . . . . 64.299999999999997 111.89 -179.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -65.25 -38.22 89.66 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 122.198 -0.314 . . . . 74.040000000000006 110.524 174.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.531 ' HA ' HD12 ' A' ' 14' ' ' ILE . 21.3 tp -70.65 -32.55 69.88 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.619 0.574 . . . . 63.299999999999997 111.023 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' A' ' 9' ' ' THR . 86.9 mt -61.91 -40.92 97.12 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.868 -0.605 . . . . 61.539999999999999 111.178 171.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 t -71.5 -27.55 63.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.312 0.645 . . . . 64.400000000000006 112.093 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 11' ' ' LEU . 75.6 mt -63.79 -37.5 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 123.395 0.678 . . . . 73.120000000000005 111.116 176.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -94.88 -87.75 0.26 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 119.584 -0.246 . . . . 74.540000000000006 110.449 175.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.421 ' HA ' HD21 ' A' ' 23' ' ' LEU . 58.2 t30 50.28 66.46 1.14 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.809 1.244 . . . . 73.319999999999993 111.798 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -85.49 -75.87 0.35 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.564 -0.744 . . . . 72.430000000000007 110.806 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -141.8 66.62 0.48 Allowed Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 111.437 -0.665 . . . . 33.119999999999997 111.437 -177.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.68 -160.11 37.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 121.411 -0.424 . . . . 74.219999999999999 112.117 179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.629 ' HE2' HG22 ' A' ' 49' ' ' ILE . 0.0 OUTLIER -70.4 -29.4 66.01 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.567 0.58 . . . . 72.120000000000005 112.567 -174.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.9 mtt180 -71.5 -44.78 64.06 Favored 'General case' 0 C--O 1.211 -0.967 0 O-C-N 123.165 0.291 . . . . 54.399999999999999 110.434 176.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.69 -27.34 68.11 Favored Glycine 0 C--N 1.337 0.591 0 O-C-N 123.552 0.533 . . . . 71.129999999999995 112.828 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' A' ' 23' ' ' LEU . 1.2 mm? -71.41 -56.44 5.95 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-O 119.403 -0.332 . . . . 70.209999999999994 111.884 172.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 97.6 mtp -72.2 -35.99 69.09 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.574 0.583 . . . . 61.409999999999997 112.574 -169.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -64.3 -45.67 86.96 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.121 0.568 . . . . 63.32 112.202 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -78.36 -24.44 46.45 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 112.166 0.432 . . . . 65.430000000000007 112.166 -177.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.782 HG23 ' HB1' ' A' ' 42' ' ' ALA . 20.8 mt -67.01 -46.52 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 119.59 -0.243 . . . . 73.310000000000002 110.648 173.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -66.2 -33.73 76.43 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 112.501 0.556 . . . . 70.109999999999999 112.501 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.01 -36.17 59.25 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 123.458 0.473 . . . . 61.119999999999997 112.145 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.722 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.28 21.07 18.06 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.966 0.728 . . . . 74.010000000000005 112.966 -172.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.481 ' HB2' ' HD3' ' A' ' 32' ' ' PRO . 79.1 mt -52.27 -53.21 55.17 Favored Pre-proline 0 CA--C 1.56 1.347 0 N-CA-C 113.402 0.889 . . . . 74.340000000000003 113.402 173.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.481 ' HD3' ' HB2' ' A' ' 31' ' ' LEU . 7.3 Cg_exo -76.33 -13.14 18.84 Favored 'Trans proline' 0 C--N 1.381 2.255 0 C-N-CA 121.982 1.788 . . . . 75.530000000000001 113.681 177.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.722 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 96.8 m-85 -81.49 -21.98 38.31 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.86 0.362 . . . . 62.520000000000003 110.742 177.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 73.0 mtm -84.52 163.82 19.16 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.863 -0.608 . . . . 63.539999999999999 110.63 171.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -85.37 177.78 7.68 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.83 -0.623 . . . . 73.109999999999999 110.518 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -42.71 -52.1 5.05 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 126.232 1.813 . . . . 75.439999999999998 114.078 -176.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -68.55 -50.59 50.71 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.301 0.64 . . . . 74.150000000000006 111.441 -176.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 62.6 mtt -70.46 -27.43 64.23 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 124.006 0.816 . . . . 35.210000000000001 112.769 -172.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.3 ttp180 -65.84 -50.88 63.01 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.526 0.73 . . . . 73.430000000000007 111.12 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.16 -32.4 63.11 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.801 0.667 . . . . 72.549999999999997 112.801 178.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.0 tp -69.17 -28.73 66.67 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 123.164 0.585 . . . . 75.25 110.777 178.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.782 ' HB1' HG23 ' A' ' 27' ' ' ILE . . . -66.12 -36.23 82.61 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 112.655 0.613 . . . . 64.530000000000001 112.655 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.4 mttt -67.86 -33.07 74.04 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 123.398 0.436 . . . . 74.140000000000001 111.591 176.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.423 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 79.4 mtp180 -68.32 -39.12 82.1 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.646 -0.706 . . . . 75.319999999999993 110.81 176.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 49' ' ' ILE . 6.9 m -73.65 -35.06 65.22 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.745 -0.661 . . . . 70.030000000000001 111.064 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 42' ' ' ALA . 79.3 mt -62.47 -38.14 88.67 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.566 0.346 . . . . 73.200000000000003 111.534 173.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.61 -15.32 62.74 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.338 -0.847 . . . . 44.32 112.43 177.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.624 ' HD2' HD12 ' A' ' 2' ' ' ILE . 46.5 mmtm -88.36 -42.03 12.46 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.505 0.558 . . . . 62.240000000000002 112.505 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.629 HG22 ' HE2' ' A' ' 20' ' ' LYS . 6.5 mt -83.26 -25.26 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 CA-C-N 117.838 0.29 . . . . 65.299999999999997 111.736 -172.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.1 -45.84 73.01 Favored Pre-proline 0 CA--C 1.552 1.019 0 N-CA-C 113.801 1.037 . . . . 75.310000000000002 113.801 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -76.0 -6.26 17.19 Favored 'Trans proline' 0 C--N 1.376 2.011 0 CA-C-N 122.194 1.819 . . . . 71.239999999999995 114.212 174.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 90.3 mt -90.96 162.38 14.77 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.033 0.444 . . . . 74.230000000000004 109.986 171.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.427 HG22 ' HG3' ' A' ' 56' ' ' GLU . 14.5 t -93.33 174.64 7.11 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 109.495 -0.558 . . . . 55.229999999999997 109.495 170.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.517 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 12.8 pt-20 -68.2 -26.89 65.96 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.202 0.601 . . . . 72.400000000000006 112.173 -179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -74.34 -40.53 62.11 Favored 'General case' 0 C--O 1.221 -0.446 0 C-N-CA 122.242 0.217 . . . . 73.219999999999999 110.863 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.427 ' HG3' HG22 ' A' ' 53' ' ' THR . 48.8 mt-10 -66.67 -37.23 84.35 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.46 0.475 . . . . 52.450000000000003 112.254 -177.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -70.11 -36.26 74.71 Favored 'General case' 0 C--O 1.217 -0.653 0 O-C-N 123.299 0.374 . . . . 73.239999999999995 110.742 175.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.99 -24.99 60.83 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.27 0.471 . . . . 74.439999999999998 112.27 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.15 -29.99 64.58 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 122.364 0.265 . . . . 74.420000000000002 111.17 175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 76.2 mt -84.86 -43.57 14.0 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.126 -0.488 . . . . 70.120000000000005 110.231 177.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.85 -110.37 0.56 Allowed 'General case' 0 C--N 1.347 0.491 0 O-C-N 125.341 1.651 . . . . 73.099999999999994 110.994 -173.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 46.6 mm -110.93 94.95 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 106.926 -1.509 . . . . 63.200000000000003 106.926 168.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -80.32 -62.59 1.63 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.33 -1.305 . . . . 73.319999999999993 111.547 -169.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.604 ' H ' HG21 ' A' ' 9' ' ' THR . . . -126.2 86.27 2.5 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.149 0.5 . . . . 75.310000000000002 111.438 -178.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -145.71 -5.34 0.64 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 73.040000000000006 111.109 176.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -90.86 25.17 2.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.494 0.664 . . . . 64.329999999999998 110.764 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -107.29 -30.78 8.52 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.403 -0.817 . . . . 71.140000000000001 109.713 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 m -105.96 32.78 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.479 -0.782 . . . . 55.310000000000002 112.314 -171.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.434 HD23 ' H ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -78.19 -4.79 49.43 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.867 -0.606 . . . . 61.229999999999997 111.214 177.63 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -86.54 -1.14 57.37 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.388 0.675 . . . . 72.120000000000005 110.788 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -68.03 103.05 1.41 Allowed 'General case' 0 C--N 1.343 0.326 0 CA-C-O 121.306 0.574 . . . . 74.409999999999997 109.91 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -141.36 114.94 8.95 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.96 -1.018 . . . . 75.239999999999995 108.483 -173.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -77.54 110.85 12.68 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 122.41 1.1 . . . . 50.439999999999998 111.097 -175.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 36.6 t-80 -149.88 91.75 1.82 Allowed 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 106.669 -1.604 . . . . 74.150000000000006 106.669 169.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -89.14 67.6 8.02 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 114.847 -1.069 . . . . 54.530000000000001 109.44 -175.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 63.4 m80 . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 124.837 1.255 . . . . 73.430000000000007 112.089 -176.788 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.481 1.109 0 CA-C-O 120.809 0.338 . . . . 22.109999999999999 110.443 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.697 HD13 ' HB2' ' A' ' 48' ' ' LYS . 10.2 tt -123.98 138.6 53.09 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 109.307 -0.627 . . . . 71.129999999999995 109.307 170.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -91.19 121.06 32.64 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.33 -0.395 . . . . 64.239999999999995 111.621 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mp -135.06 -176.17 4.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.839 -0.619 . . . . 71.510000000000005 110.65 177.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -96.01 171.38 8.66 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 116.068 -0.515 . . . . 64.239999999999995 110.37 -178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.87 HG21 ' HB2' ' A' ' 67' ' ' GLU . 17.0 mm -57.84 -47.15 86.86 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.627 0 C-N-CA 123.78 0.832 . . . . 72.549999999999997 111.517 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -60.21 -36.04 76.77 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.567 0.747 . . . . 62.240000000000002 112.64 -177.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.576 ' HG2' HD11 ' A' ' 41' ' ' LEU . 32.7 mt-10 -75.17 -41.09 58.85 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.933 0.493 . . . . 72.150000000000006 111.495 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.424 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.8 m -76.64 -28.0 55.87 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 116.18 -0.464 . . . . 62.210000000000001 111.639 178.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -71.63 -26.21 62.47 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.097 0.559 . . . . 72.340000000000003 111.267 173.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.532 HD21 ' HA ' ' A' ' 42' ' ' ALA . 50.6 tp -66.21 -31.01 71.58 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 122.628 0.371 . . . . 74.049999999999997 111.204 173.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.511 HD22 HD21 ' A' ' 23' ' ' LEU . 83.7 mt -60.36 -32.5 71.34 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.248 -0.433 . . . . 33.219999999999999 111.355 173.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.9 m -69.47 -25.58 64.15 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.286 0.635 . . . . 72.200000000000003 112.329 -179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 21.9 mm -69.18 -44.96 80.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 122.899 0.48 . . . . 73.129999999999995 111.125 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.426 ' HB2' HD12 ' A' ' 23' ' ' LEU . 82.9 m-85 -120.23 19.29 12.2 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.982 0.734 . . . . 71.120000000000005 112.982 -172.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.517 HD22 HD11 ' A' ' 62' ' ' ILE . 31.4 t-20 -67.88 106.98 2.47 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.077 0.465 . . . . 64.230000000000004 109.999 178.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -145.07 96.38 2.84 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.894 -1.048 . . . . 75.439999999999998 108.279 -178.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.46 42.68 32.98 Favored Glycine 0 N--CA 1.453 -0.195 0 C-N-CA 120.697 -0.763 . . . . 55.549999999999997 111.901 -173.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.52 -138.46 21.72 Favored Glycine 0 N--CA 1.447 -0.589 0 O-C-N 123.833 0.373 . . . . 63.219999999999999 112.474 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.741 ' HA ' ' HB3' ' A' ' 23' ' ' LEU . 2.2 pptp? -95.72 -7.96 35.88 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.796 0.351 . . . . 74.549999999999997 111.253 -177.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -63.92 -60.28 3.46 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.801 -0.636 . . . . 73.510000000000005 110.318 174.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -27.93 71.58 Favored Glycine 0 C--O 1.223 -0.579 0 CA-C-N 115.702 -0.681 . . . . 63.409999999999997 112.747 176.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.741 ' HB3' ' HA ' ' A' ' 20' ' ' LYS . 57.3 tp -59.98 -44.35 94.55 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.397 0.679 . . . . 73.329999999999998 111.406 175.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 46.5 mtt -64.16 -46.99 81.6 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.232 0.456 . . . . 42.130000000000003 112.232 176.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -63.79 -41.68 97.89 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 123.762 0.664 . . . . 74.219999999999999 111.339 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.415 ' HB3' ' CD1' ' A' ' 15' ' ' TYR . 20.5 m-80 -71.83 -38.05 70.23 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 112.508 0.559 . . . . 72.420000000000002 112.508 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 54.5 mt -70.04 -44.52 78.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 119.301 -0.38 . . . . 72.150000000000006 111.563 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -65.65 -35.58 81.21 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.283 0.475 . . . . 54.140000000000001 112.283 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.48 -29.99 64.13 Favored 'General case' 0 C--O 1.225 -0.19 0 O-C-N 123.207 0.317 . . . . 75.540000000000006 111.578 177.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.75 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -99.98 16.41 24.01 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.519 0.563 . . . . 62.439999999999998 112.519 -178.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.2 mt -67.28 -44.81 48.9 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-O 118.618 -0.706 . . . . 53.140000000000001 112.065 172.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.8 12.61 0.69 Allowed 'Trans proline' 0 C--N 1.377 2.065 0 CA-C-N 121.759 1.664 . . . . 35.009999999999998 113.911 169.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.75 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 77.4 m-85 -124.47 -154.92 0.64 Allowed 'General case' 0 C--O 1.239 0.517 0 C-N-CA 123.72 0.808 . . . . 73.549999999999997 109.222 177.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 70.8 mtm 67.47 -94.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.297 1.439 . . . . 74.299999999999997 112.796 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -174.74 147.58 1.04 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.479 -1.675 . . . . 72.120000000000005 106.479 -166.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -69.04 -38.32 79.09 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 118.403 0.547 . . . . 72.420000000000002 112.168 -177.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -67.76 -45.25 75.44 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.18 0.514 . . . . 74.019999999999996 110.705 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 18.4 ttp -73.04 -24.34 60.7 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.302 -0.863 . . . . 64.209999999999994 111.844 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 44.7 ttp180 -69.22 -39.73 78.4 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.839 0.456 . . . . 60.539999999999999 111.626 173.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -61.72 -36.34 80.66 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 121.062 0.458 . . . . 75.109999999999999 111.188 173.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.576 HD11 ' HG2' ' A' ' 8' ' ' GLU . 27.2 tp -71.36 -39.06 71.49 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 115.285 -0.87 . . . . 72.310000000000002 111.04 176.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.532 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -66.41 -32.35 73.68 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.252 0.621 . . . . 70.239999999999995 112.322 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -65.39 -44.82 86.32 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.199 -0.91 . . . . 74.420000000000002 111.992 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -80.34 -22.11 41.79 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.88 0.696 . . . . 74.310000000000002 112.88 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.508 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 60.7 m -84.24 -27.29 28.03 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 120.816 0.341 . . . . 72.319999999999993 110.868 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.422 HD23 HD11 ' A' ' 49' ' ' ILE . 28.9 mt -66.99 -33.73 76.22 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 122.101 -0.375 . . . . 73.310000000000002 111.709 168.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.52 -20.53 60.63 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 123.584 0.553 . . . . 44.530000000000001 112.239 -178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.697 ' HB2' HD13 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -87.18 -25.76 23.89 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 119.484 -0.293 . . . . 63.229999999999997 111.6 178.624 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.473 HG22 HD12 ' A' ' 52' ' ' LEU . 15.4 pt -92.66 -14.76 8.3 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 112.395 0.517 . . . . 74.409999999999997 112.395 178.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.19 -48.01 97.71 Favored Pre-proline 0 CA--C 1.554 1.133 0 N-CA-C 114.639 1.348 . . . . 74.209999999999994 114.639 175.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.98 -1.32 11.15 Favored 'Trans proline' 0 C--N 1.38 2.215 0 CA-C-N 121.96 1.736 . . . . 62.340000000000003 113.98 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.473 HD12 HG22 ' A' ' 49' ' ' ILE . 61.4 mt -86.83 149.11 25.07 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 109.202 -0.666 . . . . 72.150000000000006 109.202 177.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 t -95.02 178.23 5.62 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 108.954 -0.758 . . . . 75.239999999999995 108.954 171.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -74.19 -38.79 63.53 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 120.746 0.308 . . . . 73.150000000000006 111.553 -172.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -72.08 -29.57 64.25 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.042 -0.526 . . . . 73.019999999999996 111.021 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -71.64 -30.94 66.31 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.208 0.603 . . . . 73.0 111.18 176.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -74.53 -28.22 60.87 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 110.159 -0.311 . . . . 72.519999999999996 110.159 173.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.1 -22.22 64.0 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.967 0.349 . . . . 71.049999999999997 111.7 177.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -71.23 -37.57 72.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.938 -0.574 . . . . 71.209999999999994 111.688 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.43 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 13.2 mt -85.31 -53.01 5.49 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.142 -0.481 . . . . 74.109999999999999 110.759 -176.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.53 -109.17 0.47 Allowed 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.742 1.617 . . . . 53.229999999999997 111.136 -175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.517 HD11 HD22 ' A' ' 16' ' ' ASN . 47.3 mm -121.55 107.39 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 107.779 -1.193 . . . . 75.319999999999993 107.779 173.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.43 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 1.2 m-85 -97.03 -73.7 0.59 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.229 -0.441 . . . . 74.540000000000006 111.775 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.557 ' HB1' ' HA ' ' A' ' 6' ' ' ILE . . . -89.98 102.14 14.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.304 0.573 . . . . 62.409999999999997 111.111 -175.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -149.72 -179.15 6.89 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.139 -0.937 . . . . 71.430000000000007 108.966 178.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.8 t70 75.35 -31.14 0.2 Allowed 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 124.877 1.271 . . . . 71.049999999999997 113.331 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.87 ' HB2' HG21 ' A' ' 6' ' ' ILE . 36.7 mm-40 -70.57 -19.92 62.83 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.385 0.674 . . . . 75.439999999999998 111.781 -178.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.6 m -87.61 3.68 4.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.848 -0.614 . . . . 70.239999999999995 111.728 177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 77.1 mt -99.23 -37.07 9.44 Favored 'General case' 0 C--O 1.226 -0.161 0 N-CA-C 110.097 -0.334 . . . . 73.120000000000005 110.097 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -67.34 -55.45 13.79 Favored 'General case' 0 C--N 1.344 0.364 0 N-CA-C 108.565 -0.902 . . . . 70.120000000000005 108.565 172.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -70.33 139.43 52.02 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.327 -0.851 . . . . 72.430000000000007 109.337 175.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 76.7 123.4 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 O-C-N 125.071 1.482 . . . . 74.430000000000007 110.48 -168.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -85.25 147.56 26.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.869 -1.06 . . . . 64.310000000000002 111.142 -173.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 50.8 p-80 -69.7 158.66 34.95 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.408 -0.815 . . . . 71.340000000000003 111.748 -175.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -122.5 99.42 6.4 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.333 -0.618 . . . . 61.520000000000003 109.333 -179.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.4 t60 . . . . . 0 CA--C 1.536 0.415 0 CA-C-N 116.206 -0.452 . . . . 70.420000000000002 109.957 -179.424 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ttt . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 110.095 -0.335 . . . . 51.310000000000002 110.095 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.722 HD11 ' HG3' ' A' ' 48' ' ' LYS . 20.8 pt -81.31 154.46 4.19 Favored 'Isoleucine or valine' 0 C--O 1.24 0.579 0 N-CA-C 109.51 -0.552 . . . . 75.420000000000002 109.51 172.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 3' ' ' ARG . 5.3 mpt_? -102.17 104.23 14.8 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.695 -0.684 . . . . 72.120000000000005 109.628 -170.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.477 HD11 ' HD2' ' A' ' 48' ' ' LYS . 19.0 mt -85.51 165.45 17.11 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.766 -1.107 . . . . 52.229999999999997 109.166 178.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 17.9 p -82.64 172.6 12.76 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 109.356 -0.609 . . . . 55.200000000000003 109.356 176.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.794 HG21 ' HB2' ' A' ' 67' ' ' GLU . 18.8 mm -69.65 -22.31 25.07 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.557 -0.747 . . . . 73.219999999999999 111.01 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -67.31 -40.21 85.99 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 122.632 0.373 . . . . 72.400000000000006 111.689 175.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -65.91 -40.84 91.85 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.271 0.357 . . . . 74.310000000000002 111.213 175.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.492 HG21 ' H ' ' A' ' 64' ' ' ALA . 6.4 m -70.14 -34.77 73.46 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 115.958 -0.564 . . . . 70.510000000000005 111.467 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.485 ' O ' HG13 ' A' ' 14' ' ' ILE . 13.0 t30 -71.31 -30.82 66.69 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.659 0.784 . . . . 73.540000000000006 111.725 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.433 ' CD2' ' HA ' ' A' ' 42' ' ' ALA . 22.8 tp -62.29 -40.07 95.06 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 123.411 0.444 . . . . 74.109999999999999 111.086 176.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.401 HD13 ' HE1' ' A' ' 57' ' ' TYR . 66.1 mt -70.91 -32.47 69.41 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.336 -0.847 . . . . 73.310000000000002 111.065 177.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.0 t -70.62 -26.22 63.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.514 0.726 . . . . 75.510000000000005 112.435 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 10' ' ' ASN . 97.1 mt -61.77 -48.47 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 122.864 0.466 . . . . 54.25 111.319 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -98.0 -76.18 0.53 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.627 -0.261 . . . . 55.329999999999998 110.803 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.705 ' HA ' HD21 ' A' ' 23' ' ' LEU . 15.8 t-20 53.65 81.13 0.1 Allowed 'General case' 0 N--CA 1.474 0.739 0 O-C-N 124.925 1.391 . . . . 74.120000000000005 111.7 -177.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -102.57 -95.2 0.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.713 -0.395 . . . . 71.530000000000001 111.316 -178.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.535 ' H ' ' HA3' ' A' ' 22' ' ' GLY . . . -118.59 82.35 0.33 Allowed Glycine 0 CA--C 1.501 -0.806 0 C-N-CA 120.561 -0.828 . . . . 62.130000000000003 111.687 -177.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.63 -146.06 43.06 Favored Glycine 0 C--O 1.226 -0.379 0 N-CA-C 111.598 -0.601 . . . . 53.409999999999997 111.598 -177.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.408 ' HD3' HG22 ' A' ' 49' ' ' ILE . 2.7 pptp? -89.15 -18.2 27.64 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.518 0.159 . . . . 73.25 110.939 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.7 mtt85 -66.39 -51.15 60.0 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 123.424 0.453 . . . . 75.430000000000007 110.35 173.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.535 ' HA3' ' H ' ' A' ' 18' ' ' GLY . . . -63.89 -29.16 74.01 Favored Glycine 0 C--N 1.339 0.731 0 O-C-N 123.966 0.791 . . . . 45.439999999999998 113.051 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.705 HD21 ' HA ' ' A' ' 16' ' ' ASN . 2.4 mm? -67.9 -51.86 43.04 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-O 118.656 -0.688 . . . . 72.349999999999994 111.275 173.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.602 ' HG2' HD22 ' A' ' 46' ' ' LEU . 52.8 mtt -63.81 -42.02 97.76 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.97 0.73 . . . . 63.43 112.97 -175.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -67.78 -38.09 82.93 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 112.305 0.483 . . . . 74.030000000000001 112.305 -177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -79.79 -33.11 40.8 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.277 0.473 . . . . 73.340000000000003 112.277 178.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.5 mt -69.22 -47.72 72.5 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 118.908 -0.567 . . . . 53.530000000000001 111.374 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.505 ' HA ' ' HG ' ' A' ' 31' ' ' LEU . 35.1 m-80 -66.62 -31.13 71.63 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 112.368 0.507 . . . . 74.219999999999999 112.368 -178.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.45 -31.26 60.25 Favored 'General case' 0 N--CA 1.464 0.248 0 O-C-N 123.177 0.298 . . . . 74.209999999999994 111.721 177.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.714 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -103.57 18.15 22.5 Favored 'General case' 0 C--O 1.223 -0.31 0 N-CA-C 112.689 0.626 . . . . 71.230000000000004 112.689 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.505 ' HG ' ' HA ' ' A' ' 28' ' ' ASN . 52.5 mt -55.88 -49.31 93.66 Favored Pre-proline 0 CA--C 1.554 1.106 0 N-CA-C 114.121 1.156 . . . . 64.200000000000003 114.121 177.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -79.99 0.14 10.24 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 121.912 1.742 . . . . 62.420000000000002 113.409 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.714 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.6 m-85 -97.73 -20.83 17.33 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.197 0.199 . . . . 74.530000000000001 111.397 -179.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.3 mtt -75.08 -81.22 0.08 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.273 0.358 . . . . 72.450000000000003 111.234 -179.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.622 ' HB3' ' HB2' ' A' ' 38' ' ' MET . 34.9 t70 -179.08 161.59 1.15 Allowed 'General case' 0 C--N 1.338 0.079 0 N-CA-C 106.812 -1.551 . . . . 64.010000000000005 106.812 -170.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -62.54 -47.04 85.65 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.827 0.451 . . . . 75.040000000000006 111.326 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -76.88 -34.31 57.78 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.876 -0.602 . . . . 74.109999999999999 110.447 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.622 ' HB2' ' HB3' ' A' ' 35' ' ' ASP . 3.6 tpt -72.25 -25.48 61.64 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 123.824 0.703 . . . . 65.25 111.486 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.42 ' HG3' ' HB3' ' A' ' 31' ' ' LEU . 13.0 ttp180 -70.63 -40.55 73.05 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 122.417 0.287 . . . . 74.340000000000003 110.727 175.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.51 -30.12 64.22 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.246 0.546 . . . . 71.209999999999994 110.587 178.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 54.5 tp -71.15 -34.96 71.47 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-N 115.067 -0.969 . . . . 63.43 110.639 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.433 ' HA ' ' CD2' ' A' ' 11' ' ' LEU . . . -65.14 -40.03 93.82 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 116.164 -0.471 . . . . 65.129999999999995 111.574 175.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -68.46 -30.06 68.84 Favored 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.623 0.577 . . . . 61.0 111.553 176.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.6 tpp180 -71.07 -46.97 60.93 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.09 0.556 . . . . 74.099999999999994 111.552 176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG13 ' A' ' 49' ' ' ILE . 11.2 m -70.62 -44.04 68.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.112 -0.494 . . . . 73.129999999999995 111.302 -176.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.602 HD22 ' HG2' ' A' ' 24' ' ' MET . 52.8 mt -70.48 -27.28 64.09 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.671 0.619 . . . . 73.230000000000004 112.671 -177.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.49 -29.15 70.47 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.754 0.311 . . . . 72.510000000000005 111.704 173.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.722 ' HG3' HD11 ' A' ' 2' ' ' ILE . 14.9 tmtt? -81.53 -33.22 31.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.196 -0.457 . . . . 74.099999999999994 110.51 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.52 ' HA ' HD12 ' A' ' 52' ' ' LEU . 11.4 mt -90.8 -11.51 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-O 120.835 0.35 . . . . 70.219999999999999 111.458 -175.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.78 -46.34 99.57 Favored Pre-proline 0 CA--C 1.55 0.946 0 N-CA-C 113.889 1.07 . . . . 74.319999999999993 113.889 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -75.66 -6.45 17.62 Favored 'Trans proline' 0 C--N 1.378 2.095 0 CA-C-N 121.76 1.664 . . . . 64.409999999999997 113.542 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.52 HD12 ' HA ' ' A' ' 49' ' ' ILE . 65.3 mt -90.11 158.22 17.39 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 109.603 -0.517 . . . . 61.539999999999999 109.603 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 55' ' ' ASN . 8.7 t -112.74 -167.37 1.18 Allowed 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.19 -0.67 . . . . 72.349999999999994 109.19 171.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.41 -29.16 69.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.122 0.569 . . . . 74.530000000000001 112.129 -177.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.491 ' H ' HG23 ' A' ' 53' ' ' THR . 0.2 OUTLIER -65.0 -46.23 82.25 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 123.745 0.653 . . . . 74.129999999999995 110.348 177.143 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 2.4 mp0 -69.2 -28.79 66.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.996 0.739 . . . . 72.019999999999996 112.996 -178.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.401 ' HE1' HD13 ' A' ' 12' ' ' LEU . 77.9 t80 -72.45 -37.42 68.54 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 120.842 -0.343 . . . . 73.530000000000001 110.27 175.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.27 -14.04 60.48 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.436 0.532 . . . . 72.230000000000004 112.436 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 14.0 mm-40 -63.21 -31.55 72.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.084 0.469 . . . . 75.349999999999994 110.389 168.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 27.4 mt -89.59 -61.76 1.62 Allowed 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.498 -0.774 . . . . 55.420000000000002 109.986 178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.3 45.73 26.64 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 124.766 1.291 . . . . 53.119999999999997 112.495 178.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 40.9 mm 66.72 95.92 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 C-N-CA 124.796 1.238 . . . . 73.0 110.151 -174.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -85.21 -56.91 3.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.773 -1.103 . . . . 55.030000000000001 112.09 -171.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.492 ' H ' HG21 ' A' ' 9' ' ' THR . . . -114.9 -97.35 0.45 Allowed 'General case' 0 C--O 1.239 0.507 0 CA-C-N 115.934 -0.575 . . . . 73.129999999999995 111.75 -170.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 74.53 -33.31 0.24 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.152 1.781 . . . . 53.229999999999997 114.848 176.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.502 ' HA ' HD12 ' A' ' 69' ' ' LEU . 3.5 p30 -75.8 -17.53 59.83 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.916 0.71 . . . . 73.299999999999997 112.916 -171.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.794 ' HB2' HG21 ' A' ' 6' ' ' ILE . 29.9 mp0 -64.25 -35.96 82.52 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.386 0.674 . . . . 75.420000000000002 112.298 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.1 m -91.99 -1.69 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 111.812 0.301 . . . . 61.119999999999997 111.812 178.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.502 HD12 ' HA ' ' A' ' 66' ' ' ASP . 84.9 mt -94.14 -58.27 2.28 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.582 -0.281 . . . . 73.400000000000006 110.495 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -151.94 -55.25 0.13 Allowed 'General case' 0 C--O 1.236 0.369 0 O-C-N 123.551 0.532 . . . . 74.129999999999995 110.172 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.738 ' HB2' ' HA ' ' A' ' 67' ' ' GLU . 49.4 t60 62.64 51.34 3.17 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 124.722 1.264 . . . . 65.400000000000006 111.041 176.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -99.48 84.97 3.06 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 115.787 -0.642 . . . . 74.219999999999999 109.889 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 19.5 t60 52.84 74.49 0.29 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.192 1.397 . . . . 72.430000000000007 111.199 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -80.45 146.5 31.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.434 -0.803 . . . . 72.120000000000005 111.38 -173.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 32.2 m80 -94.2 90.08 6.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.847 -0.615 . . . . 72.420000000000002 110.122 -175.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 . . . . . 0 N--CA 1.482 1.127 0 O-C-N 124.575 1.172 . . . . 65.049999999999997 111.279 -178.86 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.554 ' HA ' HD21 ' A' ' 60' ' ' LEU . 98.7 mmm . . . . . 0 N--CA 1.479 1.001 0 N-CA-C 110.232 -0.284 . . . . 61.32 110.232 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.3 tt -148.73 140.78 17.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.484 0 N-CA-C 109.013 -0.736 . . . . 73.150000000000006 109.013 175.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.496 ' HA ' ' HD3' ' A' ' 3' ' ' ARG . 9.4 mmt-85 -87.4 106.27 17.84 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.472 0.653 . . . . 72.150000000000006 110.964 178.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.477 HD22 ' HZ2' ' A' ' 48' ' ' LYS . 96.6 mt -114.12 165.58 12.51 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-N 114.699 -1.137 . . . . 73.510000000000005 110.802 -179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.36 153.13 27.16 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.778 -0.647 . . . . 35.25 109.979 177.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.1 mm -61.41 -34.18 60.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 122.527 0.331 . . . . 74.319999999999993 110.865 176.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.1 -38.56 88.52 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 123.009 0.524 . . . . 74.409999999999997 111.4 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 36.9 mt-10 -70.42 -37.6 74.44 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 117.486 0.13 . . . . 72.439999999999998 111.31 178.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.594 ' HA ' HD12 ' A' ' 12' ' ' LEU . 5.9 m -74.81 -29.51 61.11 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 123.485 0.49 . . . . 64.319999999999993 111.369 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.465 ' O ' HG13 ' A' ' 14' ' ' ILE . 29.2 t-20 -70.92 -35.88 72.45 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.492 -0.322 . . . . 54.329999999999998 110.422 172.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.6 tp -65.95 -34.42 78.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.582 0.753 . . . . 42.450000000000003 110.882 174.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.78 ' HA ' HD11 ' A' ' 23' ' ' LEU . 95.6 mt -62.12 -39.99 94.38 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.514 -0.766 . . . . 62.109999999999999 110.831 172.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.3 t -70.41 -31.39 68.57 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.058 0.543 . . . . 34.409999999999997 112.27 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 10' ' ' ASN . 77.4 mt -68.77 -45.21 81.37 Favored 'Isoleucine or valine' 0 C--N 1.347 0.463 0 CA-C-O 120.908 0.385 . . . . 75.120000000000005 110.731 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -108.33 23.62 14.23 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.324 0.49 . . . . 75.230000000000004 112.324 -172.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 65.9 t30 -82.41 114.36 20.8 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.888 0.375 . . . . 65.209999999999994 110.221 177.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.32 -76.27 0.6 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.48 -0.782 . . . . 73.5 109.534 176.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -124.89 61.66 0.6 Allowed Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.961 -0.856 . . . . 75.430000000000007 110.961 174.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.6 -149.22 21.62 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.33 -0.462 . . . . 71.349999999999994 112.348 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.516 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -78.87 -15.26 58.57 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 111.789 0.292 . . . . 74.140000000000001 111.789 -176.489 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -68.25 -46.35 70.73 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 109.153 -0.684 . . . . 61.43 109.153 172.133 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.68 -35.54 91.35 Favored Glycine 0 C--O 1.216 -0.98 0 O-C-N 124.025 0.828 . . . . 72.349999999999994 113.217 172.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.78 HD11 ' HA ' ' A' ' 12' ' ' LEU . 1.7 mm? -64.05 -46.62 83.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 117.117 0.458 . . . . 72.140000000000001 112.097 176.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 48.9 mtt -67.8 -42.43 81.62 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.952 0.352 . . . . 74.420000000000002 111.952 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 27.5 mm-40 -70.27 -44.05 69.23 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 112.319 0.488 . . . . 71.209999999999994 112.319 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -74.56 -31.3 62.05 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.47 0.544 . . . . 74.25 112.47 -175.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.491 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 45.3 mt -72.6 -46.71 53.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 119.16 -0.448 . . . . 65.430000000000007 110.911 176.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -68.15 -25.26 65.18 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 112.693 0.627 . . . . 72.5 112.693 -179.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.07 -26.39 36.33 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 111.469 0.174 . . . . 63.450000000000003 111.469 177.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.3 5.48 39.97 Favored 'General case' 0 C--O 1.209 -1.04 0 N-CA-C 112.689 0.625 . . . . 73.109999999999999 112.689 -176.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 64.5 mt -60.6 -33.38 14.41 Favored Pre-proline 0 CA--C 1.56 1.351 0 N-CA-C 114.498 1.296 . . . . 74.140000000000001 114.498 176.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 31' ' ' LEU . 17.0 Cg_endo -60.46 -22.82 73.13 Favored 'Trans proline' 0 C--N 1.38 2.229 0 C-N-CA 122.142 1.894 . . . . 75.319999999999993 114.283 166.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -105.12 -140.15 0.37 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.057 0.943 . . . . 74.540000000000006 109.181 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 86.0 mtp 73.31 160.09 0.23 Allowed 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.834 1.654 . . . . 75.239999999999995 113.194 172.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.49 148.01 47.21 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.05 -1.093 . . . . 71.25 108.05 168.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -67.23 -28.14 67.81 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 118.661 0.664 . . . . 75.239999999999995 112.159 -178.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -66.35 -46.09 77.97 Favored 'General case' 0 C--O 1.215 -0.757 0 O-C-N 123.481 0.488 . . . . 54.140000000000001 110.671 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 11.6 mmt -75.28 -28.64 59.83 Favored 'General case' 0 C--O 1.216 -0.675 0 O-C-N 123.833 0.708 . . . . 74.299999999999997 112.549 -176.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.1 ttp180 -75.01 -48.96 21.5 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.632 0.773 . . . . 72.230000000000004 111.503 -173.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.91 -28.18 62.31 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.326 -0.397 . . . . 75.120000000000005 111.8 177.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 31.1 tp -64.97 -38.89 92.46 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 115.899 -0.591 . . . . 71.099999999999994 110.551 171.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.94 -28.42 68.27 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.355 1.062 . . . . 74.430000000000007 112.655 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.2 ttmm -60.17 -39.54 86.82 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 123.671 0.607 . . . . 63.229999999999997 110.735 173.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -79.78 -30.58 40.67 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.063 -0.517 . . . . 71.0 111.336 176.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.419 ' O ' HG12 ' A' ' 49' ' ' ILE . 73.2 m -70.45 -37.39 74.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 122.707 0.403 . . . . 53.219999999999999 111.189 -177.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.53 -31.9 63.92 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 111.406 0.15 . . . . 72.200000000000003 111.406 173.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.75 -31.54 71.53 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 123.666 0.604 . . . . 72.340000000000003 112.123 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.477 ' HZ2' HD22 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -87.31 -22.07 25.35 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.769 0.655 . . . . 61.109999999999999 112.769 -178.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 45' ' ' THR . 35.6 pt -95.23 -12.29 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.389 0.541 . . . . 74.230000000000004 112.279 178.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.36 -44.13 87.11 Favored Pre-proline 0 CA--C 1.561 1.369 0 N-CA-C 113.828 1.047 . . . . 74.319999999999993 113.828 173.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -71.96 -10.97 26.94 Favored 'Trans proline' 0 C--N 1.38 2.207 0 CA-C-N 121.767 1.667 . . . . 54.049999999999997 113.868 170.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 86.4 mt -91.57 156.15 17.86 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.99 -0.374 . . . . 74.409999999999997 109.99 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 76.2 p -92.43 -178.24 4.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.045 -0.525 . . . . 72.439999999999998 109.903 172.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -78.27 -25.01 46.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.35 -0.386 . . . . 74.530000000000001 111.018 175.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.87 -32.89 59.91 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 122.807 0.443 . . . . 75.310000000000002 111.799 173.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -63.62 -47.98 79.19 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 123.115 0.259 . . . . 71.430000000000007 110.641 173.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -69.85 -23.87 63.35 Favored 'General case' 0 C--O 1.21 -0.996 0 O-C-N 123.781 0.676 . . . . 64.0 111.931 179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.8 -35.97 75.76 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.884 0.765 . . . . 51.210000000000001 111.616 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -82.68 -24.04 33.88 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.088 -0.506 . . . . 63.119999999999997 111.903 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.554 HD21 ' HA ' ' A' ' 1' ' ' MET . 57.1 mt -101.66 16.01 27.13 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.239 0.615 . . . . 41.020000000000003 112.263 -175.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -82.78 97.39 8.57 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.228 -0.442 . . . . 41.200000000000003 110.446 -176.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.444 HG23 ' HB3' ' A' ' 65' ' ' ALA . 5.3 mp 58.19 78.81 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 125.157 1.536 . . . . 65.400000000000006 110.391 179.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.2 p90 -100.05 -23.43 14.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.832 -1.076 . . . . 74.239999999999995 111.107 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.59 ' H ' HG21 ' A' ' 9' ' ' THR . . . -148.05 80.86 1.48 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.104 0.478 . . . . 73.340000000000003 111.048 -177.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.444 ' HB3' HG23 ' A' ' 62' ' ' ILE . . . -150.94 13.15 0.69 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.01 -0.541 . . . . 75.129999999999995 111.22 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -104.14 -4.12 23.56 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.99 0.367 . . . . 74.340000000000003 111.99 -174.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -82.45 -7.75 59.63 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.956 -0.566 . . . . 60.439999999999998 110.99 177.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.9 m -102.09 10.38 8.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 116.396 -0.365 . . . . 65.319999999999993 111.184 175.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 71.9 mt -82.21 162.21 22.46 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.515 -0.311 . . . . 71.430000000000007 110.967 177.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 67.42 19.58 10.03 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.195 1.398 . . . . 72.109999999999999 111.834 -174.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -90.13 -7.21 54.28 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.626 -0.879 . . . . 75.519999999999996 108.626 167.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 44.3 p-80 -138.89 171.15 14.75 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.256 -1.338 . . . . 72.140000000000001 108.198 172.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 -112.43 138.84 48.6 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.426 -0.583 . . . . 70.430000000000007 109.426 171.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 21.1 t-80 -90.35 135.91 33.39 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.486 -0.561 . . . . 75.230000000000004 109.486 179.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -111.58 179.37 4.04 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.866 -0.606 . . . . 71.010000000000005 110.053 -177.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 . . . . . 0 CA--C 1.536 0.405 0 CA-C-N 116.113 -0.494 . . . . 52.32 110.319 175.162 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.4 ttp . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 109.701 -0.481 . . . . 72.239999999999995 109.701 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.585 HG23 HD21 ' A' ' 52' ' ' LEU . 45.3 pt -88.23 166.21 1.93 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-O 120.829 0.347 . . . . 73.109999999999999 110.964 178.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.72 117.47 34.45 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.6 -0.519 . . . . 75.099999999999994 109.6 175.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.578 ' H ' ' HZ ' ' A' ' 63' ' ' PHE . 66.0 mt -114.23 154.4 27.98 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.916 -1.038 . . . . 73.409999999999997 109.159 173.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 34.0 p -84.73 -177.25 6.54 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.481 0.178 . . . . 71.439999999999998 111.481 -178.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.762 HD13 ' HB1' ' A' ' 64' ' ' ALA . 15.7 mm -64.26 -36.42 77.03 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-N 116.361 -0.382 . . . . 74.219999999999999 110.171 177.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 24.0 mp0 -69.03 -46.35 68.15 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 122.742 0.417 . . . . 75.510000000000005 111.546 -178.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.544 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 43.9 mt-10 -68.35 -43.64 77.02 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.982 0.801 . . . . 71.239999999999995 111.399 -175.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 64' ' ' ALA . 9.1 m -74.56 -29.68 61.44 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 122.659 0.384 . . . . 41.020000000000003 111.747 -178.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -64.75 -42.56 95.08 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.6 0.36 . . . . 63.009999999999998 110.8 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.515 HD21 ' HA ' ' A' ' 42' ' ' ALA . 7.0 tp -61.83 -41.8 98.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.99 0.916 . . . . 64.430000000000007 111.606 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.808 HD22 HD21 ' A' ' 23' ' ' LEU . 65.9 mt -68.64 -31.25 70.25 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 116.204 -0.453 . . . . 73.540000000000006 111.296 178.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.6 t -70.53 -24.3 62.79 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.609 0.764 . . . . 72.310000000000002 111.751 176.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.0 mt -78.03 -42.4 27.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 122.53 0.332 . . . . 73.319999999999993 110.717 178.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -106.78 11.64 29.94 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.602 0.593 . . . . 62.130000000000003 112.602 -173.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -58.45 103.23 0.14 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.385 1.074 . . . . 73.239999999999995 111.761 175.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -101.6 -75.65 0.59 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.373 -0.83 . . . . 63.109999999999999 110.223 177.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -132.92 74.45 0.44 Allowed Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 111.416 -0.674 . . . . 71.420000000000002 111.416 -175.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.79 -136.84 19.12 Favored Glycine 0 N--CA 1.449 -0.445 0 N-CA-C 110.874 -0.89 . . . . 64.349999999999994 110.874 -176.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.88 -23.11 18.89 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 120.55 0.214 . . . . 75.030000000000001 110.857 173.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 56.7 ttp180 -74.42 -49.91 20.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.791 -0.641 . . . . 72.400000000000006 110.371 -176.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.04 -29.94 75.98 Favored Glycine 0 C--N 1.337 0.585 0 O-C-N 123.457 0.473 . . . . 74.310000000000002 112.434 172.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.808 HD21 HD22 ' A' ' 12' ' ' LEU . 63.6 tp -61.68 -43.49 98.76 Favored 'General case' 0 C--O 1.218 -0.596 0 C-N-CA 123.275 0.63 . . . . 72.129999999999995 110.949 174.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.425 ' HG2' HD13 ' A' ' 46' ' ' LEU . 55.8 mtt -70.08 -40.21 75.15 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.245 0.341 . . . . 73.409999999999997 111.81 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -64.75 -39.59 93.89 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 123.374 0.421 . . . . 74.150000000000006 111.64 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -72.86 -40.27 65.81 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 115.946 -0.57 . . . . 73.140000000000001 110.921 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.422 ' HA ' ' HE1' ' A' ' 34' ' ' MET . 32.6 mt -67.38 -46.33 83.87 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-O 119.155 -0.45 . . . . 74.209999999999994 112.192 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 24.9 m-80 -67.35 -25.24 65.89 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.098 0.777 . . . . 75.420000000000002 113.098 -176.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.89 -35.42 24.13 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.476 0.176 . . . . 70.239999999999995 111.476 175.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.532 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -98.45 16.07 22.86 Favored 'General case' 0 C--N 1.332 -0.152 0 N-CA-C 113.078 0.77 . . . . 73.329999999999998 113.078 -172.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 56.8 mt -53.44 -51.18 78.15 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 114.373 1.249 . . . . 72.049999999999997 114.373 -179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.53 -23.52 57.36 Favored 'Trans proline' 0 C--N 1.38 2.22 0 CA-C-N 121.834 1.691 . . . . 74.129999999999995 113.409 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.532 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 15.0 m-85 -92.7 10.84 28.95 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.109 0.563 . . . . 73.519999999999996 111.127 -173.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.445 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 62.8 mtt -99.17 16.29 23.28 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 116.009 -0.541 . . . . 73.400000000000006 111.823 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 70.29 -77.05 0.06 Allowed 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.956 1.302 . . . . 72.129999999999995 111.976 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -168.65 -53.91 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.199 0.6 . . . . 50.130000000000003 109.728 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -70.48 -36.07 73.63 Favored 'General case' 0 CA--C 1.516 -0.335 0 O-C-N 123.682 0.614 . . . . 71.109999999999999 112.049 -172.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 16.2 mmt -74.36 -29.57 61.62 Favored 'General case' 0 C--O 1.213 -0.82 0 O-C-N 123.363 0.415 . . . . 72.430000000000007 111.461 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 35.1 ttm180 -70.9 -52.5 19.7 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.45 0.3 . . . . 74.420000000000002 111.584 -177.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -66.64 -36.21 82.01 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.818 -0.628 . . . . 64.209999999999994 111.395 -176.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.456 HD11 ' HG2' ' A' ' 8' ' ' GLU . 27.7 tp -70.57 -34.81 72.62 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.8 -0.636 . . . . 54.25 111.02 177.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.515 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -66.96 -37.78 84.89 Favored 'General case' 0 C--O 1.214 -0.77 0 N-CA-C 112.611 0.597 . . . . 61.439999999999998 112.611 -177.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -73.17 -33.59 65.52 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 123.004 0.19 . . . . 64.040000000000006 111.43 178.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 44' ' ' ARG . 64.3 mtt180 -67.58 -43.11 81.36 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.518 0.511 . . . . 64.450000000000003 111.324 174.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 49' ' ' ILE . 21.8 m -76.53 -30.59 57.19 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-N 116.173 -0.467 . . . . 53.409999999999997 111.274 -177.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.425 HD13 ' HG2' ' A' ' 24' ' ' MET . 12.7 mt -69.98 -30.1 67.36 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 118.724 0.693 . . . . 72.340000000000003 112.035 175.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.54 -19.31 60.94 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.362 0.414 . . . . 72.140000000000001 111.291 173.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 tttp -88.76 -24.31 22.68 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.009 0.523 . . . . 74.329999999999998 111.365 177.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.508 HG23 HD12 ' A' ' 52' ' ' LEU . 15.4 mt -94.09 -8.53 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 121.322 0.582 . . . . 75.239999999999995 109.771 175.191 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.8 -41.48 77.49 Favored Pre-proline 0 CA--C 1.557 1.243 0 CA-C-O 118.026 -0.988 . . . . 71.230000000000004 113.509 174.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.47 1.71 8.5 Favored 'Trans proline' 0 C--N 1.381 2.278 0 CA-C-N 121.677 1.635 . . . . 75.230000000000004 114.124 170.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.585 HD21 HG23 ' A' ' 2' ' ' ILE . 54.0 mt -96.73 169.31 9.96 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.976 -0.379 . . . . 75.349999999999994 109.976 176.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 16.9 p -105.67 -170.64 1.77 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.013 -0.54 . . . . 72.409999999999997 109.798 168.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -23.35 44.74 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.767 -0.457 . . . . 73.400000000000006 109.767 171.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -66.23 -46.3 77.68 Favored 'General case' 0 C--O 1.221 -0.407 0 C-N-CA 123.798 0.839 . . . . 61.109999999999999 109.52 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.455 ' HB2' ' HB3' ' A' ' 52' ' ' LEU . 17.6 mm-40 -67.18 -29.54 69.25 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.883 0.74 . . . . 75.510000000000005 112.986 179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -74.73 -36.7 62.65 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 110.43 -0.211 . . . . 75.5 110.43 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.64 -14.98 60.39 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.156 0.428 . . . . 62.100000000000001 112.156 177.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -67.51 -42.96 82.0 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 122.191 0.196 . . . . 74.409999999999997 111.309 172.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.532 ' HB2' ' CD1' ' A' ' 63' ' ' PHE . 0.8 OUTLIER -86.45 -44.96 11.59 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 120.939 -0.304 . . . . 73.209999999999994 111.36 178.111 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 55.3 34.41 22.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.292 1.437 . . . . 65.099999999999994 114.44 166.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 35.3 mm 67.02 93.22 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 122.452 1.12 . . . . 73.120000000000005 109.904 -173.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.578 ' HZ ' ' H ' ' A' ' 4' ' ' LEU . 21.6 p90 -117.35 -2.58 11.55 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.084 -1.417 . . . . 65.209999999999994 111.592 -171.187 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.762 ' HB1' HD13 ' A' ' 6' ' ' ILE . . . -153.82 75.31 1.03 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.09 0.471 . . . . 71.310000000000002 111.527 -173.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -142.58 -0.15 1.24 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.397 -0.365 . . . . 64.030000000000001 111.068 177.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -80.86 -30.88 35.57 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.835 -0.621 . . . . 44.299999999999997 111.84 -171.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -82.41 -14.87 54.47 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.955 0.724 . . . . 72.430000000000007 112.955 -166.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.9 m -95.3 -3.24 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 111.749 0.277 . . . . 73.439999999999998 111.749 176.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 78.0 mt -114.8 -66.51 1.08 Allowed 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 109.253 -0.647 . . . . 74.230000000000004 109.253 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.695 ' HG2' ' H ' ' A' ' 75' ' ' HIS . 17.6 mt-10 -85.49 100.86 12.18 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 124.096 0.872 . . . . 74.340000000000003 108.718 178.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -116.51 -0.42 12.47 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.96 0.409 . . . . 71.209999999999994 111.559 -173.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -132.95 -59.16 0.9 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.921 -0.4 . . . . 64.230000000000004 109.921 177.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -133.18 -77.69 0.48 Allowed 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 108.899 -0.778 . . . . 62.149999999999999 108.899 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.1 m80 -140.05 143.65 36.47 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 109.416 -0.587 . . . . 62.310000000000002 109.416 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.695 ' H ' ' HG2' ' A' ' 70' ' ' GLU . 18.0 m170 65.11 177.56 0.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 125.129 1.372 . . . . 65.209999999999994 113.893 177.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.486 -0.779 . . . . 73.109999999999999 109.33 172.742 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ttt . . . . . 0 N--CA 1.476 0.846 0 N-CA-C 110.037 -0.357 . . . . 75.109999999999999 110.037 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.1 tt -83.01 120.29 34.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 108.488 -0.93 . . . . 74.219999999999999 108.488 169.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.461 ' HD2' ' HA ' ' A' ' 3' ' ' ARG . 10.2 tpt180 -90.03 111.47 22.58 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.308 -0.997 . . . . 65.430000000000007 108.308 -178.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.515 HD12 ' HE1' ' A' ' 63' ' ' PHE . 58.3 mt -81.49 142.55 32.8 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-N 114.898 -1.046 . . . . 65.430000000000007 110.623 -171.35 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.411 HG22 ' HG3' ' A' ' 8' ' ' GLU . 11.5 t -82.0 166.33 19.91 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-N 115.436 -0.802 . . . . 74.439999999999998 109.448 -174.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.514 HG22 HG13 ' A' ' 68' ' ' VAL . 21.9 mm -59.7 -33.06 50.85 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.681 0 O-C-N 123.663 0.602 . . . . 74.310000000000002 110.951 -177.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -70.6 -38.91 74.05 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.416 0.895 . . . . 73.310000000000002 113.416 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 48.4 mt-10 -68.17 -41.06 82.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.08 0.467 . . . . 72.510000000000005 110.889 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.685 HG21 ' H ' ' A' ' 64' ' ' ALA . 2.7 m -74.61 -29.07 61.17 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 115.127 -0.942 . . . . 44.219999999999999 111.468 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -65.45 -38.81 90.95 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.399 0.68 . . . . 63.140000000000001 110.688 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.488 HD21 ' HA ' ' A' ' 42' ' ' ALA . 59.9 tp -65.34 -33.67 76.51 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.897 -0.592 . . . . 63.219999999999999 110.939 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 77.9 mt -66.07 -36.84 84.29 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-N 115.899 -0.591 . . . . 61.399999999999999 110.801 173.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 m -65.07 -23.63 67.22 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 112.288 0.477 . . . . 43.310000000000002 112.288 178.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 29.9 mt -85.19 -39.83 14.35 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 N-CA-C 111.677 0.251 . . . . 54.130000000000003 111.677 -179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -120.24 0.81 10.72 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 114.804 1.409 . . . . 65.049999999999997 114.804 -166.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.484 ' HB2' HD23 ' A' ' 23' ' ' LEU . 4.3 t30 -86.65 121.78 29.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 118.448 0.567 . . . . 72.120000000000005 110.15 178.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.28 -14.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.843 -0.343 . . . . 71.439999999999998 111.873 173.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.56 61.9 0.32 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.483 -0.865 . . . . 61.340000000000003 113.573 -173.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.59 -161.53 51.49 Favored Glycine 0 C--O 1.225 -0.458 0 C-N-CA 121.442 -0.409 . . . . 63.25 113.372 174.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.926 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 54.5 tttt -75.06 -37.15 61.72 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 123.666 0.274 . . . . 75.409999999999997 111.432 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.6 mtm180 -65.23 -48.65 72.58 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-O 118.976 -0.535 . . . . 73.200000000000003 110.964 177.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.37 -35.92 91.72 Favored Glycine 0 C--O 1.222 -0.627 0 O-C-N 123.654 0.596 . . . . 53.329999999999998 112.858 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.484 HD23 ' HB2' ' A' ' 16' ' ' ASN . 2.4 tm? -62.02 -50.67 71.11 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.443 0.697 . . . . 65.140000000000001 110.591 176.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.893 ' HG2' HD22 ' A' ' 46' ' ' LEU . 40.7 mtt -71.66 -40.49 69.63 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 112.615 0.598 . . . . 70.099999999999994 112.615 -175.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.97 -35.43 78.36 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 123.294 0.372 . . . . 61.240000000000002 111.255 -179.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.2 t-20 -66.6 -48.61 68.97 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 123.358 0.411 . . . . 60.399999999999999 109.957 175.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.438 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 11.8 mt -61.88 -43.58 97.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 O-C-N 123.732 0.645 . . . . 64.129999999999995 112.255 -179.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -64.67 -36.46 84.34 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.467 0.543 . . . . 75.329999999999998 112.467 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.11 -27.47 54.05 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.547 -0.297 . . . . 55.439999999999998 111.696 178.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.531 ' O ' ' HG3' ' A' ' 34' ' ' MET . . . -102.8 15.02 30.52 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 112.864 0.69 . . . . 74.120000000000005 112.864 -175.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 79.2 mt -58.05 -47.47 98.81 Favored Pre-proline 0 CA--C 1.556 1.176 0 N-CA-C 113.681 0.993 . . . . 74.400000000000006 113.681 178.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -83.19 10.41 3.67 Favored 'Trans proline' 0 C--N 1.378 2.122 0 C-N-CA 121.849 1.699 . . . . 73.519999999999996 113.603 173.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.458 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 98.2 m-85 -109.81 -3.62 16.56 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.045 0.538 . . . . 74.420000000000002 110.217 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 64.1 mtt -91.7 174.39 7.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.514 -0.766 . . . . 63.210000000000001 110.877 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.66 166.55 23.38 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 108.99 -0.744 . . . . 71.209999999999994 108.99 163.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -73.8 -30.47 62.75 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.787 -0.571 . . . . 74.230000000000004 110.919 -178.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -72.26 -33.86 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.212 -0.449 . . . . 71.519999999999996 110.718 174.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.3 ttm -75.0 -27.5 60.17 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 115.724 -0.671 . . . . 71.549999999999997 110.919 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -75.7 -43.1 48.9 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.516 0.726 . . . . 62.350000000000001 111.923 -177.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -72.13 -29.02 63.65 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.658 -0.246 . . . . 73.140000000000001 110.994 174.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.96 -30.98 68.47 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 116.148 -0.478 . . . . 75.129999999999995 110.278 174.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.543 ' O ' ' HG ' ' A' ' 46' ' ' LEU . . . -62.78 -43.32 99.11 Favored 'General case' 0 C--O 1.215 -0.743 0 C-N-CA 123.004 0.522 . . . . 75.219999999999999 111.75 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -69.41 -33.9 73.67 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.365 0.416 . . . . 73.340000000000003 111.578 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -65.3 -42.94 92.54 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.347 -0.842 . . . . 60.32 110.727 176.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.806 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 90.6 m -74.24 -36.32 63.89 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.973 -1.012 . . . . 73.319999999999993 111.665 -178.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.893 HD22 ' HG2' ' A' ' 24' ' ' MET . 49.4 mt -69.43 -31.1 69.22 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.814 -0.553 . . . . 64.340000000000003 112.384 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.64 91.81 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.668 0.618 . . . . 65.430000000000007 112.668 -177.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.806 ' HE3' ' HA ' ' A' ' 45' ' ' THR . 0.0 OUTLIER -88.93 -7.71 55.54 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.197 0.814 . . . . 64.140000000000001 113.197 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.453 HG22 ' HG3' ' A' ' 20' ' ' LYS . 49.8 mt -97.53 -20.83 5.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.964 0.412 . . . . 63.329999999999998 109.901 174.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -50.28 -43.69 79.09 Favored Pre-proline 0 CA--C 1.559 1.301 0 N-CA-C 115.64 1.718 . . . . 74.25 115.64 177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -80.15 8.64 3.99 Favored 'Trans proline' 0 C--N 1.385 2.458 0 CA-C-N 122.289 1.853 . . . . 74.109999999999999 114.474 178.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 40.1 mt -100.48 145.73 27.92 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 110.172 -0.307 . . . . 73.109999999999999 110.172 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.5 t -98.15 29.01 3.7 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-O 121.502 0.667 . . . . 73.439999999999998 110.852 179.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.926 ' HG2' ' HB3' ' A' ' 20' ' ' LYS . 47.3 mt-10 83.35 -28.66 0.1 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 126.706 2.002 . . . . 72.349999999999994 112.85 172.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -72.4 -33.58 67.27 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.028 0.442 . . . . 74.409999999999997 110.931 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -76.97 -29.15 55.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.472 -0.785 . . . . 75.450000000000003 110.485 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -71.91 -29.64 64.54 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-N 116.402 -0.363 . . . . 65.019999999999996 110.848 173.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.47 80.68 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.973 0.416 . . . . 73.310000000000002 110.968 173.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -72.63 -32.2 65.72 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.921 -1.036 . . . . 54.240000000000002 111.117 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 97.4 mt -86.5 -82.24 0.21 Allowed 'General case' 0 C--O 1.236 0.355 0 N-CA-C 110.074 -0.343 . . . . 72.219999999999999 110.074 176.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 53.34 -131.06 2.14 Favored 'General case' 0 C--N 1.35 0.626 0 C-N-CA 125.224 1.41 . . . . 44.43 111.537 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.4 mp -92.66 88.19 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 N-CA-C 108.495 -0.928 . . . . 61.020000000000003 108.495 178.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.515 ' HE1' HD12 ' A' ' 4' ' ' LEU . 19.0 p90 -110.04 -32.54 6.98 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.454 -0.794 . . . . 74.140000000000001 111.36 -178.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.685 ' H ' HG21 ' A' ' 9' ' ' THR . . . -133.81 64.96 1.59 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.63 0.729 . . . . 63.32 111.235 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -132.17 20.3 4.45 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.779 0.799 . . . . 73.409999999999997 110.259 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -95.69 12.99 27.9 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.567 -0.742 . . . . 74.049999999999997 111.294 -176.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -111.35 9.74 21.56 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.969 -0.559 . . . . 75.230000000000004 111.826 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.514 HG13 HG22 ' A' ' 6' ' ' ILE . 28.5 m -108.82 11.88 8.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 120.565 0.222 . . . . 73.439999999999998 111.188 177.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.1 mp -83.37 85.05 7.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.208 -0.451 . . . . 62.350000000000001 110.494 -175.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 54.42 50.77 15.46 Favored 'General case' 0 C--N 1.346 0.431 0 O-C-N 125.039 1.462 . . . . 73.120000000000005 111.078 -175.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -74.98 -41.52 59.39 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 114.72 -1.127 . . . . 71.519999999999996 109.41 -178.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 46.3 t60 -143.49 114.62 7.85 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.044 -1.095 . . . . 65.120000000000005 108.044 169.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -147.92 146.82 29.17 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.835 -0.621 . . . . 74.349999999999994 110.528 -177.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -140.66 -60.62 0.51 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.514 -0.551 . . . . 71.129999999999995 109.514 174.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 57.2 t60 60.47 91.87 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 125.006 1.441 . . . . 72.420000000000002 110.966 -173.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 27.7 p80 . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 115.339 -0.846 . . . . 73.299999999999997 111.332 -179.74 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 120.918 0.39 . . . . 62.210000000000001 110.118 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.811 HD11 ' HB3' ' A' ' 48' ' ' LYS . 15.1 tt -86.35 150.85 3.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 115.48 -0.782 . . . . 52.350000000000001 109.98 178.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.95 98.15 7.51 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.465 1.126 . . . . 74.510000000000005 109.862 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 35.9 mt -106.23 152.67 23.2 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.605 -1.18 . . . . 65.209999999999994 109.508 174.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.1 p -81.47 163.63 22.6 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.347 -0.541 . . . . 71.230000000000004 109.775 173.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.517 HG23 ' HB1' ' A' ' 64' ' ' ALA . 31.0 mm -67.62 -29.17 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 116.006 -0.543 . . . . 70.230000000000004 111.135 -174.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -70.86 -37.43 73.1 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.966 -0.561 . . . . 73.450000000000003 110.974 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.4 ' O ' ' HG ' ' A' ' 12' ' ' LEU . 50.0 mt-10 -73.95 -37.04 64.67 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.604 0.594 . . . . 71.150000000000006 112.604 -179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.743 ' HB ' ' HB3' ' A' ' 64' ' ' ALA . 3.4 m -74.88 -29.32 60.97 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.738 0.304 . . . . 74.340000000000003 110.647 178.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.446 ' O ' HG13 ' A' ' 14' ' ' ILE . 24.5 t-20 -67.61 -38.89 84.61 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.096 -0.335 . . . . 74.549999999999997 110.096 171.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.754 HD21 ' HA ' ' A' ' 42' ' ' ALA . 19.1 tp -60.71 -38.54 85.41 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.984 0.913 . . . . 72.200000000000003 111.64 175.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 8' ' ' GLU . 89.5 mt -66.77 -32.72 74.19 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.836 -0.62 . . . . 44.5 111.423 174.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.0 t -72.0 -29.04 63.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 123.243 0.617 . . . . 64.25 112.081 177.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.69 HD12 ' HA ' ' A' ' 11' ' ' LEU . 71.8 mt -66.44 -42.69 90.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.119 0.568 . . . . 75.400000000000006 110.051 178.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.422 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . 75.9 m-85 -111.03 35.28 3.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.809 -0.632 . . . . 74.530000000000001 110.91 -175.317 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -83.31 103.7 12.9 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.482 0.658 . . . . 64.010000000000005 111.815 -172.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.517 ' HG2' HD22 ' A' ' 26' ' ' ASN . 4.7 pt-20 -142.3 122.2 13.59 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.793 -1.094 . . . . 64.439999999999998 110.122 171.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.04 -96.65 2.0 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.66 -0.7 . . . . 73.230000000000004 111.762 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.25 -131.28 1.2 Allowed Glycine 0 C--O 1.216 -0.973 0 N-CA-C 110.667 -0.973 . . . . 55.009999999999998 110.667 178.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -64.46 -46.18 84.19 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.63 0.772 . . . . 62.030000000000001 111.034 -177.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -71.03 -47.89 56.09 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 123.372 0.42 . . . . 74.150000000000006 111.047 -175.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.65 -29.58 75.45 Favored Glycine 0 C--N 1.336 0.53 0 O-C-N 123.868 0.73 . . . . 64.540000000000006 113.531 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.2 -43.83 98.25 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.468 0.307 . . . . 73.519999999999996 111.097 171.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.839 ' HG2' HD22 ' A' ' 46' ' ' LEU . 49.2 mtt -68.72 -38.63 80.36 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.335 0.397 . . . . 45.240000000000002 111.004 177.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.06 -44.99 94.27 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.171 0.434 . . . . 73.430000000000007 112.171 178.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.517 HD22 ' HG2' ' A' ' 17' ' ' GLU . 28.2 t-20 -69.48 -43.47 73.12 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.584 0.553 . . . . 60.119999999999997 110.576 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.48 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 30.9 mt -63.78 -48.19 87.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 119.12 -0.467 . . . . 71.239999999999995 111.972 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.7 -30.47 67.05 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.695 0.628 . . . . 73.209999999999994 112.695 -176.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.93 -33.72 66.12 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 123.033 0.208 . . . . 61.240000000000002 111.011 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.582 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -95.84 7.57 45.95 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.792 0.664 . . . . 51.240000000000002 112.792 -176.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 49.3 mt -60.93 -44.7 95.59 Favored Pre-proline 0 N--CA 1.481 1.119 0 N-CA-C 113.954 1.094 . . . . 64.329999999999998 113.954 178.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -65.35 -19.59 61.7 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.023 1.815 . . . . 72.120000000000005 114.312 174.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.582 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 20.2 m-85 -96.94 -10.49 26.25 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.713 0.292 . . . . 74.230000000000004 110.395 -178.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.3 ttm -86.35 143.23 27.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.918 -0.583 . . . . 72.010000000000005 110.718 -171.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -61.42 145.56 51.29 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.851 0.719 . . . . 53.450000000000003 109.413 172.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -60.06 -30.58 69.3 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.887 1.069 . . . . 72.439999999999998 113.887 -173.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -70.06 -44.61 68.81 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 121.02 0.438 . . . . 64.310000000000002 110.704 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 60.1 ttm -74.5 -29.65 61.5 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.133 -0.939 . . . . 72.200000000000003 111.292 179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.427 ' HG3' HD22 ' A' ' 31' ' ' LEU . 22.4 ttt180 -69.26 -44.89 70.99 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.736 0.814 . . . . 73.450000000000003 111.729 -178.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -70.53 -33.2 70.91 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-N 116.305 -0.407 . . . . 73.349999999999994 111.176 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 37.2 tp -67.91 -40.09 83.46 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.862 -0.608 . . . . 72.439999999999998 110.431 175.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.754 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -60.92 -45.08 96.07 Favored 'General case' 0 C--O 1.22 -0.452 0 C-N-CA 123.91 0.884 . . . . 60.119999999999997 113.125 -176.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -66.48 -30.16 70.44 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.469 0.481 . . . . 70.5 112.094 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 -76.6 -33.48 58.43 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 123.128 0.267 . . . . 73.129999999999995 111.532 177.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.3 m -71.37 -31.3 67.15 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.569 0.348 . . . . 61.520000000000003 110.505 174.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.839 HD22 ' HG2' ' A' ' 24' ' ' MET . 63.1 mt -68.61 -30.27 68.97 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 122.642 0.377 . . . . 74.439999999999998 111.379 174.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.88 -19.12 61.35 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 123.21 0.319 . . . . 54.439999999999998 111.639 175.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.811 ' HB3' HD11 ' A' ' 2' ' ' ILE . 5.8 mttt -84.43 -37.16 21.78 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.701 0.401 . . . . 62.109999999999999 111.8 175.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.78 -9.31 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 112.7 0.63 . . . . 61.119999999999997 112.7 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.4 -48.96 96.42 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-O 117.911 -1.042 . . . . 65.420000000000002 113.54 173.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.63 -4.81 15.42 Favored 'Trans proline' 0 C--N 1.385 2.468 0 CA-C-N 121.646 1.623 . . . . 73.239999999999995 113.977 176.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.547 HD11 HD12 ' A' ' 2' ' ' ILE . 43.6 mt -89.26 145.95 25.06 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 109.654 -0.499 . . . . 73.140000000000001 109.654 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.485 HG23 ' H ' ' A' ' 56' ' ' GLU . 11.5 t -83.62 163.24 20.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.741 -0.663 . . . . 72.219999999999999 109.805 172.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -61.53 -39.65 91.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.019 0.928 . . . . 73.209999999999994 111.477 -179.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -68.9 -35.49 76.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.834 -0.621 . . . . 74.049999999999997 112.323 -176.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' H ' HG23 ' A' ' 53' ' ' THR . 39.2 tt0 -75.87 -33.54 59.98 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 123.248 0.342 . . . . 72.430000000000007 111.033 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -69.89 -30.64 68.13 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 123.026 0.204 . . . . 71.409999999999997 111.034 177.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.43 -24.2 63.8 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.044 0.387 . . . . 74.5 112.044 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -76.0 -27.29 57.35 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.251 -0.431 . . . . 55.009999999999998 111.294 175.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.482 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . 25.8 mt -81.53 -55.32 4.75 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 115.922 -0.581 . . . . 64.450000000000003 110.757 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 54.88 -110.3 0.55 Allowed 'General case' 0 C--N 1.348 0.503 0 O-C-N 125.114 1.509 . . . . 63.43 110.183 -168.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.427 HG23 HG22 ' A' ' 9' ' ' THR . 48.3 mm -121.47 105.43 16.56 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 109.111 -0.7 . . . . 63.409999999999997 109.111 175.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.482 ' CE2' ' HA ' ' A' ' 60' ' ' LEU . 2.7 m-85 -97.48 24.16 6.9 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.026 -0.534 . . . . 73.230000000000004 111.813 178.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.743 ' HB3' ' HB ' ' A' ' 9' ' ' THR . . . -148.96 -149.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.315 -0.402 . . . . 44.219999999999999 110.114 -177.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 72.34 12.84 5.66 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.348 1.459 . . . . 55.240000000000002 112.435 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.405 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 32.3 t70 -101.5 -32.15 10.54 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 121.123 0.487 . . . . 74.230000000000004 110.479 -179.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.405 ' HB2' HG21 ' A' ' 6' ' ' ILE . 35.4 mt-10 -81.99 -13.13 57.85 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.403 -0.362 . . . . 72.25 111.776 176.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.9 m -112.27 35.54 0.77 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 116.425 -0.352 . . . . 62.450000000000003 111.756 -177.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 66' ' ' ASP . 96.0 mt -66.72 -44.49 81.46 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.319 -0.4 . . . . 70.299999999999997 111.235 177.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -92.31 -63.96 1.17 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.775 -0.648 . . . . 70.349999999999994 110.931 -175.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 2.2 t60 61.2 35.55 18.34 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.96 1.304 . . . . 73.319999999999993 108.901 -167.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 58.2 m80 62.83 -161.02 0.3 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.46 1.104 . . . . 74.530000000000001 110.883 -172.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -93.31 11.5 27.93 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.155 0.798 . . . . 74.430000000000007 113.155 -172.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -155.65 154.11 31.07 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.692 -0.484 . . . . 72.450000000000003 109.692 176.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.5 m80 72.34 113.47 0.06 Allowed 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 125.345 1.458 . . . . 75.049999999999997 112.323 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 60.4 t-80 . . . . . 0 N--CA 1.476 0.831 0 C-N-CA 124.51 1.124 . . . . 75.040000000000006 110.916 178.389 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.591 ' HG3' HD22 ' A' ' 60' ' ' LEU . 12.3 tmm? . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 109.648 -0.501 . . . . 72.219999999999999 109.648 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.764 HD13 ' HB3' ' A' ' 48' ' ' LYS . 93.3 mt 75.61 -45.84 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 125.148 1.379 . . . . 65.129999999999995 114.185 172.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 85.11 80.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 127.426 2.29 . . . . 72.420000000000002 108.595 -171.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.493 HD22 ' HG2' ' A' ' 8' ' ' GLU . 76.6 mt -121.56 166.9 13.52 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 113.511 -1.677 . . . . 73.239999999999995 108.395 175.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 15.3 t -98.67 173.52 6.86 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 109.244 -0.65 . . . . 65.400000000000006 109.244 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.564 HG21 ' HB2' ' A' ' 67' ' ' GLU . 10.7 mm -60.32 -24.94 32.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.953 1.301 . . . . 72.239999999999995 112.192 -175.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -71.89 -37.79 70.09 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.724 0.809 . . . . 72.219999999999999 112.564 -178.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.522 ' HA ' HD11 ' A' ' 41' ' ' LEU . 1.3 mp0 -63.74 -43.96 94.94 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 121.174 0.512 . . . . 72.25 110.943 178.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.432 ' HA ' ' HG ' ' A' ' 12' ' ' LEU . 6.7 p -74.96 -25.36 58.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.659 -1.155 . . . . 54.140000000000001 112.666 178.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.469 ' O ' HG13 ' A' ' 14' ' ' ILE . 4.0 t-20 -66.52 -33.51 75.83 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.916 0.486 . . . . 55.509999999999998 111.151 174.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.432 ' HA ' HD12 ' A' ' 14' ' ' ILE . 58.7 tp -62.91 -33.96 76.42 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 122.816 0.446 . . . . 71.340000000000003 110.891 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.847 HD22 HD21 ' A' ' 23' ' ' LEU . 13.8 mt -71.46 -38.61 71.27 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.517 -0.765 . . . . 64.549999999999997 110.433 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.436 ' HB3' HG21 ' A' ' 62' ' ' ILE . 78.6 p -72.04 -22.19 61.42 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.785 0.661 . . . . 73.25 112.785 179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 10' ' ' ASN . 99.3 mt -60.88 -47.42 93.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.78 0.324 . . . . 73.310000000000002 110.218 174.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -91.91 -78.09 0.41 Allowed 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.22 -0.445 . . . . 54.32 110.947 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.6 t30 52.96 71.34 0.49 Allowed 'General case' 0 N--CA 1.473 0.72 0 O-C-N 124.727 1.267 . . . . 71.340000000000003 110.094 -172.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -140.31 123.25 16.53 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.495 -1.229 . . . . 73.219999999999999 109.818 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.34 21.24 79.46 Favored Glycine 0 CA--C 1.523 0.555 0 N-CA-C 115.272 0.869 . . . . 75.109999999999999 115.272 168.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.71 -140.49 29.17 Favored Glycine 0 C--N 1.335 0.476 0 C-N-CA 121.294 -0.479 . . . . 53.420000000000002 112.595 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.811 ' HB3' ' HA ' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -76.8 -33.68 57.98 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 123.745 0.32 . . . . 64.319999999999993 111.307 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.502 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 38.6 mtt180 -65.28 -61.42 2.13 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 119.427 -0.321 . . . . 71.409999999999997 110.96 177.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.28 -30.82 78.71 Favored Glycine 0 C--O 1.214 -1.111 0 O-C-N 124.56 1.163 . . . . 40.399999999999999 113.924 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.847 HD21 HD22 ' A' ' 12' ' ' LEU . 26.3 tp -65.18 -48.86 71.96 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 117.317 0.558 . . . . 63.130000000000003 110.632 177.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.0 mtp -69.95 -36.79 75.55 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 123.423 0.452 . . . . 72.140000000000001 111.435 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 21' ' ' ARG . 62.4 mm-40 -68.74 -39.86 80.12 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.269 0.355 . . . . 74.510000000000005 111.779 179.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -69.59 -42.77 74.0 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-O 119.382 -0.342 . . . . 35.219999999999999 111.397 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.421 ' O ' ' HG ' ' A' ' 31' ' ' LEU . 40.3 mt -62.88 -43.73 99.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 O-C-N 123.784 0.677 . . . . 75.239999999999995 112.051 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.25 -39.79 95.61 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 113.06 0.763 . . . . 74.329999999999998 113.06 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.7 -22.71 29.67 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.83 0.678 . . . . 71.519999999999996 112.83 -177.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.652 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -114.47 19.39 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.14 0.793 . . . . 63.340000000000003 113.14 -171.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 27' ' ' ILE . 39.3 mt -51.0 -52.58 56.81 Favored Pre-proline 0 CA--C 1.552 1.049 0 N-CA-C 114.117 1.154 . . . . 71.340000000000003 114.117 174.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.48 -15.1 41.3 Favored 'Trans proline' 0 C--N 1.382 2.327 0 C-N-CA 121.777 1.651 . . . . 72.230000000000004 114.101 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.652 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 55.6 m-85 -96.58 -1.27 47.32 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.278 0.231 . . . . 74.200000000000003 111.452 -175.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 30' ' ' ALA . 66.6 mtt -78.19 -77.82 0.15 Allowed 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.941 0.4 . . . . 63.149999999999999 111.548 178.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -162.88 -90.36 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.107 -0.951 . . . . 62.219999999999999 109.136 -167.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 176.18 -51.92 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.765 1.226 . . . . 74.239999999999995 108.218 -174.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -73.69 -38.08 64.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.248 -0.887 . . . . 63.109999999999999 109.366 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.427 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.1 OUTLIER -62.47 -25.69 68.13 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.628 -1.169 . . . . 73.040000000000006 113.237 178.096 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -62.56 -52.6 62.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.138 0.575 . . . . 75.040000000000006 111.202 176.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -68.88 -36.19 77.78 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.441 0.696 . . . . 73.219999999999999 111.551 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.522 HD11 ' HA ' ' A' ' 8' ' ' GLU . 61.4 tp -59.64 -38.08 80.42 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.581 1.153 . . . . 54.0 111.807 179.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.8 -36.29 82.66 Favored 'General case' 0 C--O 1.218 -0.572 0 O-C-N 124.121 0.888 . . . . 70.099999999999994 113.273 -176.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -60.34 -40.82 92.04 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.704 0.628 . . . . 64.219999999999999 111.856 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 44' ' ' ARG . 48.0 mtm105 -76.2 -35.18 59.19 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.631 0.604 . . . . 75.129999999999995 112.631 -178.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.439 HG21 HD21 ' A' ' 12' ' ' LEU . 1.7 m -79.11 -38.6 35.78 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.597 0.221 . . . . 74.209999999999994 111.597 -176.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -66.6 -31.09 71.57 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.273 0.472 . . . . 72.530000000000001 112.273 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.81 -23.71 64.3 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.638 0.586 . . . . 74.329999999999998 111.555 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.764 ' HB3' HD13 ' A' ' 2' ' ' ILE . 73.9 mmtt -88.56 -28.3 20.82 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.256 -0.429 . . . . 63.340000000000003 112.033 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.432 ' HA ' HD12 ' A' ' 52' ' ' LEU . 35.6 mt -93.01 -21.11 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 N-CA-C 110.703 -0.11 . . . . 71.329999999999998 110.703 -178.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -53.43 -47.58 95.75 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 114.687 1.365 . . . . 72.510000000000005 114.687 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -81.16 5.64 6.11 Favored 'Trans proline' 0 C--N 1.383 2.346 0 CA-C-N 121.902 1.715 . . . . 72.319999999999993 114.385 176.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.432 HD12 ' HA ' ' A' ' 49' ' ' ILE . 96.1 mt -98.75 168.19 10.3 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.502 -0.555 . . . . 74.329999999999998 109.502 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.443 ' OG1' ' HG2' ' A' ' 56' ' ' GLU . 63.5 p -102.96 -179.81 4.06 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.753 -0.462 . . . . 74.409999999999997 109.753 173.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.811 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -75.11 -22.71 58.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.858 -0.61 . . . . 63.520000000000003 110.721 174.336 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -74.39 -35.77 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.442 -0.799 . . . . 75.150000000000006 110.489 175.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.443 ' HG2' ' OG1' ' A' ' 53' ' ' THR . 21.5 mm-40 -70.9 -39.22 72.88 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.242 -0.436 . . . . 63.130000000000003 110.876 176.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -70.05 -28.21 65.28 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.173 -0.467 . . . . 73.129999999999995 111.045 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.19 -28.55 68.19 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 111.836 0.31 . . . . 60.420000000000002 111.836 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -72.43 -30.23 64.42 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 122.459 0.303 . . . . 63.310000000000002 111.792 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.591 HD22 ' HG3' ' A' ' 1' ' ' MET . 17.6 mt -79.01 -54.39 6.07 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.749 -0.463 . . . . 75.140000000000001 109.749 -178.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 52.21 42.93 31.0 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 125.214 1.571 . . . . 74.140000000000001 112.975 174.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.46 HG13 ' HB2' ' A' ' 12' ' ' LEU . 3.2 mp 68.98 112.45 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.981 0.912 . . . . 64.049999999999997 109.368 -168.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -87.68 -31.43 19.74 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.339 -0.846 . . . . 64.129999999999995 111.298 -171.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.464 ' HB1' HG23 ' A' ' 6' ' ' ILE . . . -154.42 128.26 8.78 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.024 0.44 . . . . 61.140000000000001 111.459 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -155.59 170.17 22.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.844 -0.616 . . . . 73.409999999999997 110.231 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.43 ' HA ' ' HG ' ' A' ' 69' ' ' LEU . 0.9 OUTLIER 75.82 -26.33 0.19 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 125.155 1.382 . . . . 70.019999999999996 113.401 177.557 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.564 ' HB2' HG21 ' A' ' 6' ' ' ILE . 7.6 mm-40 -76.02 -14.11 60.22 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.897 0.879 . . . . 65.519999999999996 111.372 -178.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 m -123.27 15.08 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 116.232 -0.44 . . . . 54.140000000000001 111.954 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.43 ' HG ' ' HA ' ' A' ' 66' ' ' ASP . 30.2 mt -77.73 146.77 35.73 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.671 0.249 . . . . 73.219999999999999 111.671 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.415 ' HG2' ' HA ' ' A' ' 76' ' ' HIS . 16.8 mt-10 56.88 34.49 24.88 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.357 1.063 . . . . 72.230000000000004 112.472 176.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 2.3 m80 -87.99 -171.14 3.27 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 115.931 -0.577 . . . . 75.099999999999994 110.456 177.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -82.15 85.08 6.85 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.956 0.884 . . . . 74.329999999999998 113.004 -170.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -168.89 -58.81 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 113.141 -1.845 . . . . 74.310000000000002 106.236 170.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -135.62 154.66 51.25 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.099 -0.501 . . . . 74.239999999999995 110.551 177.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -89.52 146.58 24.51 Favored 'General case' 0 C--O 1.241 0.619 0 N-CA-C 107.944 -1.132 . . . . 74.349999999999994 107.944 173.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.415 ' HA ' ' HG2' ' A' ' 70' ' ' GLU . 91.6 m-70 . . . . . 0 N--CA 1.481 1.103 0 O-C-N 124.549 1.156 . . . . 61.030000000000001 111.706 -174.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ptp . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.766 0.317 . . . . 73.409999999999997 110.648 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.581 HG21 ' HG3' ' A' ' 48' ' ' LYS . 12.5 tt -72.75 142.51 15.03 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 115.653 -0.703 . . . . 74.349999999999994 109.547 171.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -74.98 110.42 9.26 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.653 -0.869 . . . . 73.319999999999993 108.653 176.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.57 HD11 ' HD2' ' A' ' 48' ' ' LYS . 90.4 mt -116.43 157.27 25.4 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.514 -0.767 . . . . 62.409999999999997 110.935 178.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.488 HG22 ' HG2' ' A' ' 8' ' ' GLU . 8.2 t -90.27 169.66 10.93 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 115.475 -0.784 . . . . 61.049999999999997 108.889 167.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.685 HG21 ' HB2' ' A' ' 67' ' ' GLU . 17.1 mm -63.38 -32.02 55.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.414 0.686 . . . . 74.409999999999997 112.203 -176.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -71.52 -24.28 61.93 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.57 0.581 . . . . 64.319999999999993 112.57 -176.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.502 ' HB3' HG23 ' A' ' 45' ' ' THR . 32.5 mm-40 -63.82 -52.53 59.75 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.492 0.663 . . . . 74.120000000000005 110.307 176.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -26.4 61.08 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.648 -1.16 . . . . 75.409999999999997 112.25 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.499 ' HB2' HG21 ' A' ' 68' ' ' VAL . 12.4 t30 -66.92 -39.59 87.4 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 122.733 0.413 . . . . 75.200000000000003 111.152 172.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.631 HD21 ' HA ' ' A' ' 42' ' ' ALA . 27.6 tp -69.43 -37.12 77.27 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.296 0.638 . . . . 65.129999999999995 111.153 175.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 79.7 mt -66.11 -32.06 73.3 Favored 'General case' 0 C--O 1.211 -0.959 0 CA-C-N 115.932 -0.576 . . . . 75.329999999999998 111.743 176.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.1 t -65.75 -32.58 74.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.798 0.687 . . . . 64.010000000000005 111.292 177.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 62.6 mt -67.08 -36.66 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 123.3 0.64 . . . . 53.240000000000002 110.854 177.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -116.59 28.5 8.52 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.303 0.483 . . . . 65.319999999999993 112.303 -173.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -83.44 95.76 8.35 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.41 -0.359 . . . . 74.299999999999997 110.948 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -166.4 136.06 3.17 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-N 115.932 -0.576 . . . . 52.530000000000001 110.007 -179.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.38 23.68 60.34 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 115.316 0.886 . . . . 53.450000000000003 115.316 169.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.85 -144.5 31.33 Favored Glycine 0 C--O 1.222 -0.631 0 CA-C-N 117.216 0.508 . . . . 63.219999999999999 112.331 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -79.25 -36.92 39.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.523 0.329 . . . . 75.450000000000003 110.702 176.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -64.8 -47.84 76.61 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.321 -0.399 . . . . 75.310000000000002 110.903 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -66.68 -35.56 90.01 Favored Glycine 0 C--O 1.219 -0.822 0 CA-C-O 119.326 -0.708 . . . . 54.420000000000002 112.773 176.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.91 -47.19 83.56 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 122.939 0.495 . . . . 70.200000000000003 111.172 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.458 ' HG2' HD22 ' A' ' 46' ' ' LEU . 42.9 mtt -68.98 -35.59 76.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.792 -0.64 . . . . 71.120000000000005 112.133 -179.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -72.57 -33.56 66.87 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.01 0.374 . . . . 74.340000000000003 112.01 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -71.03 -37.63 72.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 122.658 0.383 . . . . 71.409999999999997 111.383 176.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.2 mt -73.29 -41.95 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 116.211 -0.45 . . . . 71.420000000000002 111.349 178.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -70.25 -28.97 65.66 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.92 0.711 . . . . 60.439999999999998 112.92 -179.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.23 -28.49 62.19 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.597 0.237 . . . . 72.420000000000002 111.306 176.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.569 ' HA ' ' HD2' ' A' ' 33' ' ' PHE . . . -107.27 17.83 22.38 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.285 -0.416 . . . . 65.140000000000001 112.072 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 17.9 mt -68.33 -40.77 21.69 Favored Pre-proline 0 CA--C 1.544 0.728 0 CA-C-O 117.925 -1.036 . . . . 72.400000000000006 112.968 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.13 -3.0 12.46 Favored 'Trans proline' 0 C--N 1.382 2.305 0 CA-C-N 121.778 1.671 . . . . 74.129999999999995 113.885 168.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.569 ' HD2' ' HA ' ' A' ' 30' ' ' ALA . 97.0 m-85 -109.29 -164.01 0.91 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.201 0.6 . . . . 71.120000000000005 110.021 -179.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 76.4 mtm 65.9 -169.9 0.2 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 125.035 1.334 . . . . 51.539999999999999 111.776 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -76.05 163.29 27.28 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.775 -0.648 . . . . 73.319999999999993 109.683 167.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -73.82 -24.73 59.83 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.726 -0.472 . . . . 73.019999999999996 109.726 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -66.09 -44.35 84.67 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.749 -0.659 . . . . 73.510000000000005 110.537 172.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . 0.47 ' HG3' HD13 ' A' ' 11' ' ' LEU . 3.2 tpt -75.99 -25.81 56.14 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.421 -0.809 . . . . 63.350000000000001 111.205 -178.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.0 ttm180 -70.86 -44.65 65.94 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.501 1.12 . . . . 74.340000000000003 111.4 177.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -68.65 -33.38 73.9 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.13 -0.487 . . . . 74.209999999999994 111.566 174.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 19.2 tp -66.21 -37.72 86.26 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.601 -0.727 . . . . 64.239999999999995 110.643 175.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.631 ' HA ' HD21 ' A' ' 11' ' ' LEU . . . -60.68 -37.66 82.36 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 113.571 0.952 . . . . 52.399999999999999 113.571 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -78.71 -27.44 44.94 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.133 0.271 . . . . 63.229999999999997 111.662 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -36.09 74.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.586 0.354 . . . . 75.450000000000003 111.153 172.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.502 HG23 ' HB3' ' A' ' 8' ' ' GLU . 1.6 m -81.24 -25.19 36.84 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.902 0.382 . . . . 71.209999999999994 111.583 178.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.458 HD22 ' HG2' ' A' ' 24' ' ' MET . 29.5 mt -66.58 -27.35 67.65 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 121.982 -0.449 . . . . 73.319999999999993 111.608 168.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.75 -18.17 64.17 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.332 0.493 . . . . 75.040000000000006 112.332 172.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.581 ' HG3' HG21 ' A' ' 2' ' ' ILE . 65.3 tttt -70.23 -56.48 6.69 Favored 'General case' 0 C--O 1.224 -0.265 0 N-CA-C 110.07 -0.344 . . . . 75.219999999999999 110.07 170.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.8 mt -85.39 -20.23 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 112.833 0.679 . . . . 73.109999999999999 112.833 -163.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.87 95.88 Favored Pre-proline 0 CA--C 1.557 1.228 0 N-CA-C 114.202 1.186 . . . . 72.430000000000007 114.202 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -78.47 -4.28 14.04 Favored 'Trans proline' 0 C--N 1.377 2.075 0 CA-C-N 121.565 1.595 . . . . 64.049999999999997 114.161 172.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 48' ' ' LYS . 78.6 mt -85.38 133.57 34.12 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 109.433 -0.58 . . . . 74.439999999999998 109.433 176.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -89.19 24.43 2.16 Favored 'General case' 0 CA--C 1.564 1.519 0 N-CA-C 112.763 0.653 . . . . 73.319999999999993 112.763 -172.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 76.64 -48.55 0.55 Allowed 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 126.21 1.804 . . . . 64.019999999999996 112.732 173.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -64.48 -37.01 86.06 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.69 0.757 . . . . 70.150000000000006 109.657 170.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -68.67 -35.03 76.7 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.382 -1.281 . . . . 65.5 111.32 174.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -72.47 -24.9 61.25 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.919 0.487 . . . . 74.239999999999995 111.313 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -71.56 -22.57 61.73 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.88 0.696 . . . . 63.340000000000003 112.88 -177.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.03 -29.48 49.42 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.837 0.351 . . . . 74.340000000000003 111.009 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 44.9 mt -88.89 -66.99 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.656 -0.702 . . . . 74.430000000000007 110.829 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . 48.68 -105.76 0.16 Allowed 'General case' 0 CA--C 1.536 0.442 0 O-C-N 125.439 1.712 . . . . 72.439999999999998 112.304 -174.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 22.1 mm -115.41 104.31 16.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 108.595 -0.891 . . . . 75.010000000000005 108.595 177.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -110.41 -3.27 16.19 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.026 -0.534 . . . . 74.010000000000005 112.033 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -150.08 79.67 1.36 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.213 0.53 . . . . 52.32 111.63 -177.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.452 ' O ' ' HG ' ' A' ' 69' ' ' LEU . . . -131.74 12.93 4.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.238 0.542 . . . . 65.030000000000001 110.389 173.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -76.34 -34.7 58.98 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.274 -0.876 . . . . 71.510000000000005 110.956 -176.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.685 ' HB2' HG21 ' A' ' 6' ' ' ILE . 8.6 mm-40 -75.88 -31.37 59.2 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.216 -0.902 . . . . 73.209999999999994 111.754 -175.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.499 HG21 ' HB2' ' A' ' 10' ' ' ASN . 3.9 m -85.07 -2.16 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 112.923 0.712 . . . . 62.299999999999997 112.923 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 65' ' ' ALA . 95.1 mt -72.14 -47.28 52.16 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.966 0.412 . . . . 72.510000000000005 110.63 174.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -101.36 76.09 1.67 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.656 0.741 . . . . 74.209999999999994 111.225 -174.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 68' ' ' VAL . 26.9 m170 -127.61 86.82 2.53 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 114.529 -1.214 . . . . 73.219999999999999 108.094 169.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 29.5 m170 69.87 168.54 0.3 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 125.147 1.379 . . . . 61.450000000000003 111.199 -169.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -127.77 25.31 6.01 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.343 0.592 . . . . 75.450000000000003 110.377 -178.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -84.91 95.0 8.9 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.176 -0.676 . . . . 74.420000000000002 109.176 175.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 61.6 105.49 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.154 1.382 . . . . 71.420000000000002 111.88 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 14.6 t60 . . . . . 0 N--CA 1.483 1.201 0 O-C-N 124.237 0.961 . . . . 74.310000000000002 110.547 -179.597 . . . . . . . . 0 0 . 1 stop_ save_